2-[(4-azanylcyclohexyl)amino]-N-[(3,4-diethoxyphenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-[(4-azanylcyclohexyl)amino]-N-[(3,4-diethoxyphenyl)methyl]-5-nitro-benzamide Openeye Name: 2-[(4-aminocyclohexyl)amino]-N-[(3,4-diethoxyphenyl)methyl]-5-nitro-benzamide CAS Name: 2-[(4-aminocyclohexyl)amino]-N-[(3,4-diethoxyphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-[(4-aminocyclohexyl)amino]-N-[(3,4-diethoxyphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-[(4-aminocyclohexyl)amino]-N-(3,4-diethoxybenzyl)-5-nitro-benzamide Formula: C24H32N4O5 MolecularWeight: 456.53468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)N)OCC

InChI

InChI=1S/C24H32N4O5/c1-3-32-22-12-5-16(13-23(22)33-4-2)15-26-24(29)20-14-19(28(30)31)10-11-21(20)27-18-8-6-17(25)7-9-18/h5,10-14,17-18,27H,3-4,6-9,15,25H2,1-2H3,(H,26,29)