ethyl 3-nitro-5-[[2-(1-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[2-(1-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[2-(1-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[2-[oxo-(1-phenylethylamino)methyl]anilino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[2-(1-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[2-(1-phenylethylcarbamoyl)phenyl]carbamoyl]benzoic acid ethyl ester Formula: C25H23N3O6 MolecularWeight: 461.46662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O6/c1-3-34-25(31)19-13-18(14-20(15-19)28(32)33)23(29)27-22-12-8-7-11-21(22)24(30)26-16(2)17-9-5-4-6-10-17/h4-16H,3H2,1-2H3,(H,26,30)(H,27,29)