[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 4-oxidanyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: [2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 4-oxidanyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: [2-(benzhydrylamino)-2-oxo-ethyl] 4-hydroxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-hydroxy-1-phenyl-3-pyrazolecarboxylic acid [2-[(diphenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(benzhydrylamino)-2-oxoethyl] 4-hydroxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-hydroxy-1-phenyl-pyrazole-3-carboxylic acid [2-(benzhydrylamino)-2-keto-ethyl] ester Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)COC(=O)C3=NN(C=C3O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)COC(=O)C3=NN(C=C3O)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O4/c29-21-16-28(20-14-8-3-9-15-20)27-24(21)25(31)32-17-22(30)26-23(18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1-16,23,29H,17H2,(H,26,30)