N-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[4-(4-chlorobenzoyl)piperazino]phenyl]-2-methyl-3-nitro-benzamide Formula: C25H23ClN4O4 MolecularWeight: 478.92752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN4O4/c1-17-20(5-4-8-22(17)30(33)34)24(31)27-21-6-2-3-7-23(21)28-13-15-29(16-14-28)25(32)18-9-11-19(26)12-10-18/h2-12H,13-16H2,1H3,(H,27,31)