N-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[4-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazino]phenyl]-4-ethoxy-3-nitro-benzamide Formula: C28H30N4O7 MolecularWeight: 534.5604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H30N4O7/c1-4-39-26-10-5-19(17-25(26)32(35)36)27(33)29-21-6-8-22(9-7-21)30-11-13-31(14-12-30)28(34)20-15-23(37-2)18-24(16-20)38-3/h5-10,15-18H,4,11-14H2,1-3H3,(H,29,33)