6-[(3,4-dimethoxyphenyl)methyl]-3-(methylamino)-5-nitro-9-oxidanylidene-1-phenyl-2-propyl-10H-acridine-4-carboxamide

Systemtic Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-(methylamino)-5-nitro-9-oxidanylidene-1-phenyl-2-propyl-10H-acridine-4-carboxamide Openeye Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-(methylamino)-5-nitro-9-oxo-1-phenyl-2-propyl-10H-acridine-4-carboxamide CAS Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-(methylamino)-5-nitro-9-oxo-1-phenyl-2-propyl-10H-acridine-4-carboxamide IUPAC Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-(methylamino)-5-nitro-9-oxo-1-phenyl-2-propyl-10H-acridine-4-carboxamide Traditional Name: 9-keto-3-(methylamino)-5-nitro-1-phenyl-2-propyl-6-veratryl-10H-acridine-4-carboxamide Formula: C33H32N4O6 MolecularWeight: 580.63038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1C3=CC=CC=C3)C(=O)C4=C(N2)C(=C(C=C4)CC5=CC(=C(C=C5)OC)OC)[N+](=O)[O-])C(=O)N)NC

Isomeric SMILES

CCCC1=C(C(=C2C(=C1C3=CC=CC=C3)C(=O)C4=C(N2)C(=C(C=C4)CC5=CC(=C(C=C5)OC)OC)[N+](=O)[O-])C(=O)N)NC

InChI

InChI=1S/C33H32N4O6/c1-5-9-21-25(19-10-7-6-8-11-19)26-30(27(33(34)39)28(21)35-2)36-29-22(32(26)38)14-13-20(31(29)37(40)41)16-18-12-15-23(42-3)24(17-18)43-4/h6-8,10-15,17,35H,5,9,16H2,1-4H3,(H2,34,39)(H,36,38)