2-chloranyl-N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-5-nitro-benzamide Formula: C25H22Cl2N4O4 MolecularWeight: 513.37258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H22Cl2N4O4/c1-16-5-7-17(8-6-16)25(33)30-13-11-29(12-14-30)23-21(27)3-2-4-22(23)28-24(32)19-15-18(31(34)35)9-10-20(19)26/h2-10,15H,11-14H2,1H3,(H,28,32)