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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=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(=CC=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/c1-21-7-5-9-23(19-21)31-29(35)32(18-17-30-28(34)22-8-6-10-25(20-22)33(36)37)24-13-15-27(16-14-24)38-26-11-3-2-4-12-26/h2-16,19-20H,17-18H2,1H3,(H,30,34)(H,31,35)