[2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 3-methyl-2-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 3-methyl-2-nitro-benzoate Openeye Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-oxo-2-[2-[oxo-(1-phenylethylamino)methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid [2-keto-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] ester Formula: C25H23N3O6 MolecularWeight: 461.46662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C25H23N3O6/c1-16-9-8-13-20(23(16)28(32)33)25(31)34-15-22(29)27-21-14-7-6-12-19(21)24(30)26-17(2)18-10-4-3-5-11-18/h3-14,17H,15H2,1-2H3,(H,26,30)(H,27,29)