(2-oxidanylidene-2-phenylazanyl-ethyl) 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 4-(3,4-dimethoxyphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)OCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)OCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H23N3O5/c1-32-22-14-13-18(15-23(22)33-2)21-16-29(20-11-7-4-8-12-20)28-25(21)26(31)34-17-24(30)27-19-9-5-3-6-10-19/h3-16H,17H2,1-2H3,(H,27,30)