N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-[4-(4-ethylbenzoyl)piperazino]phenyl]-3-methyl-4-nitro-benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C27H28N4O4/c1-3-20-4-6-21(7-5-20)27(33)30-16-14-29(15-17-30)24-11-9-23(10-12-24)28-26(32)22-8-13-25(31(34)35)19(2)18-22/h4-13,18H,3,14-17H2,1-2H3,(H,28,32)