IUPAC Name: methyl,2-[3-[[1-(2-ethylphenyl)-2,4,6-trioxo-1,,3-diazinan

[Synonyms]

[Structure]

[ Properties Computed from Structure]

Molecular Weight	431.44064 [g/mol]
Molecular Formula	C24H21N3O5
XLogP	3.2
H-Bond Donor	1
H-Bond Acceptor	6
Rotatable Bond Count	6
Tautomer Count	3
Exact Mass	431.148121
MonoIsotopic Mass	431.148121
Topological Polar Surface Area	97.7
Heavy Atom Count	32
Formal Charge	0
Complexity	810
Isotope Atom Count	0
Defined Atom StereoCenter Count	0
Undefined Atom StereoCenter Count	0
Defined Bond StereoCenter Count	0
Undefined Bond StereoCenter Count	1
Covalently-Bonded Unit Count	1

[ Descriptors Computed from Structure]
IUPAC Name: methyl
2-[3-[[1-(2-ethylphenyl)-2,4,6-trioxo-1,
3-diazinan-5-ylidene]methyl]indol-1-yl]acetate
Canonical SMILES: CCC1=CC=CC=C1N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)OC)C(=O)NC2=O
InChI: InChI=1/C24H21N3O5/c1-3-15-8-4-6-10-19(15)27-23(30)18(22(29)25-24(27)31)
12-16-13-26(14-21(28)32-2)20-11-7-5-9-17(16)20/h4-13H,3,14H2,1-2H3,(H,
25,29,31)/f/h25H