1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[4-(methylamino)butyl]-9-oxidanylidene-N-phenyl-10H-acridine-4-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[4-(methylamino)butyl]-9-oxidanylidene-N-phenyl-10H-acridine-4-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[4-(methylamino)butyl]-9-oxo-N-phenyl-10H-acridine-4-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[4-(methylamino)butyl]-9-oxo-N-phenyl-10H-acridine-4-carboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-[4-(methylamino)butyl]-9-oxo-N-phenyl-10H-acridine-4-carboxamide Traditional Name: 1-homoveratryl-9-keto-N-[4-(methylamino)butyl]-N-phenyl-10H-acridine-4-carboxamide Formula: C35H37N3O4 MolecularWeight: 563.68598

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCN(C1=CC=CC=C1)C(=O)C2=C3C(=C(C=C2)CCC4=CC(=C(C=C4)OC)OC)C(=O)C5=CC=CC=C5N3

Isomeric SMILES

CNCCCCN(C1=CC=CC=C1)C(=O)C2=C3C(=C(C=C2)CCC4=CC(=C(C=C4)OC)OC)C(=O)C5=CC=CC=C5N3

InChI

InChI=1S/C35H37N3O4/c1-36-21-9-10-22-38(26-11-5-4-6-12-26)35(40)28-19-18-25(17-15-24-16-20-30(41-2)31(23-24)42-3)32-33(28)37-29-14-8-7-13-27(29)34(32)39/h4-8,11-14,16,18-20,23,36H,9-10,15,17,21-22H2,1-3H3,(H,37,39)