4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-3-nitro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-3-nitro-N-[[4-(1-pyrrolidinyl)phenyl]methyl]benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Traditional Name: 4-(4-acetylpiperazino)-3-nitro-N-(4-pyrrolidinobenzyl)benzamide Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O4/c1-18(30)26-12-14-28(15-13-26)22-9-6-20(16-23(22)29(32)33)24(31)25-17-19-4-7-21(8-5-19)27-10-2-3-11-27/h4-9,16H,2-3,10-15,17H2,1H3,(H,25,31)