2-methyl-3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 2-methyl-3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]-2-methyl-3-nitro-benzamide Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O4/c1-18-22(8-5-9-23(18)29(32)33)24(30)26-20-10-12-21(13-11-20)27-14-16-28(17-15-27)25(31)19-6-3-2-4-7-19/h2-13H,14-17H2,1H3,(H,26,30)