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

Systemtic Name: N-[4-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-[4-(3,5-dimethoxybenzoyl)piperazino]phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C30H33N5O6 MolecularWeight: 559.61292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-])OC

InChI

InChI=1S/C30H33N5O6/c1-40-25-17-22(18-26(20-25)41-2)30(37)34-15-13-32(14-16-34)24-8-6-23(7-9-24)31-29(36)21-5-10-27(28(19-21)35(38)39)33-11-3-4-12-33/h5-10,17-20H,3-4,11-16H2,1-2H3,(H,31,36)