N-[2-[(4-methylphenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[(4-methylphenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3-nitro-benzamide Openeye Name: 3-nitro-N-[2-[4-phenoxy-N-(p-tolylcarbamoyl)anilino]ethyl]benzamide CAS Name: N-[2-(N-[(4-methylanilino)-oxomethyl]-4-phenoxyanilino)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[N-[(4-methylphenyl)carbamoyl]-4-phenoxyanilino]ethyl]-3-nitrobenzamide Traditional Name: 3-nitro-N-[2-[4-phenoxy-N-(p-tolylcarbamoyl)anilino]ethyl]benzamide Formula: C29H26N4O5 MolecularWeight: 510.54054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H26N4O5/c1-21-10-12-23(13-11-21)31-29(35)32(19-18-30-28(34)22-6-5-7-25(20-22)33(36)37)24-14-16-27(17-15-24)38-26-8-3-2-4-9-26/h2-17,20H,18-19H2,1H3,(H,30,34)(H,31,35)