N-[(4-methylphenyl)methyl]-4-nitro-N-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]phenyl]benzamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-nitro-N-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]phenyl]benzamide Openeye Name: 4-nitro-N-[3-[2-oxo-2-(phenethylamino)ethyl]phenyl]-N-(p-tolylmethyl)benzamide CAS Name: N-[(4-methylphenyl)methyl]-4-nitro-N-[3-[2-oxo-2-(phenethylamino)ethyl]phenyl]benzamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-nitro-N-[3-[2-oxo-2-(phenethylamino)ethyl]phenyl]benzamide Traditional Name: N-[3-[2-keto-2-(phenethylamino)ethyl]phenyl]-N-(4-methylbenzyl)-4-nitro-benzamide Formula: C31H29N3O4 MolecularWeight: 507.57966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=CC(=C2)CC(=O)NCCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=CC(=C2)CC(=O)NCCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C31H29N3O4/c1-23-10-12-25(13-11-23)22-33(31(36)27-14-16-28(17-15-27)34(37)38)29-9-5-8-26(20-29)21-30(35)32-19-18-24-6-3-2-4-7-24/h2-17,20H,18-19,21-22H2,1H3,(H,32,35)