N-[3-[(2-methylphenyl)carbonylamino]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[3-[(2-methylphenyl)carbonylamino]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-[(2-methylbenzoyl)amino]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-[[(2-methylphenyl)-oxomethyl]amino]phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[3-[(2-methylbenzoyl)amino]phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-N-[3-(o-toluoylamino)phenyl]-4-pyrrolidino-benzamide Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

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