4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(4-ethoxyphenyl)-3-nitro-benzamide

Systemtic Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(4-ethoxyphenyl)-3-nitro-benzamide Openeye Name: 4-[3-(3,5-dimethyl-1-piperidyl)propylamino]-N-(4-ethoxyphenyl)-3-nitro-benzamide CAS Name: 4-[3-(3,5-dimethyl-1-piperidinyl)propylamino]-N-(4-ethoxyphenyl)-3-nitrobenzamide IUPAC Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(4-ethoxyphenyl)-3-nitrobenzamide Traditional Name: 4-[3-(3,5-dimethylpiperidino)propylamino]-3-nitro-N-p-phenetyl-benzamide Formula: C25H34N4O4 MolecularWeight: 454.56186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCCN3CC(CC(C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCCN3CC(CC(C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H34N4O4/c1-4-33-22-9-7-21(8-10-22)27-25(30)20-6-11-23(24(15-20)29(31)32)26-12-5-13-28-16-18(2)14-19(3)17-28/h6-11,15,18-19,26H,4-5,12-14,16-17H2,1-3H3,(H,27,30)