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

Systemtic Name: N-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[4-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazino]phenyl]-4-methoxy-3-nitro-benzamide Formula: C27H28N4O7 MolecularWeight: 520.53382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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

COC1=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/C27H28N4O7/c1-36-22-14-19(15-23(17-22)37-2)27(33)30-12-10-29(11-13-30)21-7-5-20(6-8-21)28-26(32)18-4-9-25(38-3)24(16-18)31(34)35/h4-9,14-17H,10-13H2,1-3H3,(H,28,32)