[2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 4-pyrazol-1-ylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(1-phenylethylcarbamoyl)phenyl]amino]ethyl] 4-pyrazol-1-ylbenzoate Openeye Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [2-oxo-2-[2-[oxo-(1-phenylethylamino)methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [2-keto-2-[2-(1-phenylethylcarbamoyl)anilino]ethyl] ester Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C27H24N4O4/c1-19(20-8-3-2-4-9-20)29-26(33)23-10-5-6-11-24(23)30-25(32)18-35-27(34)21-12-14-22(15-13-21)31-17-7-16-28-31/h2-17,19H,18H2,1H3,(H,29,33)(H,30,32)