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W-7, Hydrochloride,W 7, monohydrochloride ,W-7 HYDROCHLORIDE,C16H21ClN

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摘 要:W-7, Hydrochloride,W 7, monohydrochloride ,W-7 HYDROCHLORIDE,C16H21ClN2O2S.HCl,MLS000859986,A3281_SIGMA,SPECTRUM1503627,NSC683545,NCGC00093583-02,SMR000326845, N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide hydrochloride,Canonical SMILES: C1=CC2=
[Synonyms]
W-7, Hydrochloride
W 7, monohydrochloride
W-7 HYDROCHLORIDE
C16H21ClN2O2S.HCl
MLS000859986
A3281_SIGMA
SPECTRUM1503627
NSC683545
NCGC00093583-02
SMR000326845

[Structure]
W-7, Hydrochloride,W 7, monohydrochloride ,W-7 HYDROCHLORIDE,C16H21ClN

[ Properties Computed from Structure]
Molecular Weight377.32908 [g/mol]
Molecular FormulaC16H22Cl2N2O2S
H-Bond Donor3
H-Bond Acceptor4
Rotatable Bond Count8
Exact Mass376.077904
MonoIsotopic Mass376.077904
Topological Polar Surface Area72.2
Heavy Atom Count23
Formal Charge0
Complexity424
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count2

[ Descriptors Computed from Structure]
IUPAC Name: N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide hydrochloride
Canonical SMILES: C1=CC2=C(C=CC=C2Cl)C(=C1)S(=O)(=O)NCCCCCCN.Cl
InChI: InChI=1/C16H21ClN2O2S.ClH/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,
21)19-12-4-2-1-3-11-18;/h5-10,19H,1-4,11-12,18H2;1H

 
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