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

Systemtic Name: 4-chloranyl-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-3-nitro-N-[4-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C25H23ClN4O4 MolecularWeight: 478.92752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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