[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(2,5-dimethoxyphenyl)-1-phenyl-4-pyrazolecarboxylic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 3-(2,5-dimethoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxylic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)OCC(=O)NC3CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)OCC(=O)NC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O5/c1-29-17-10-11-20(30-2)18(12-17)22-19(13-26(25-22)16-6-4-3-5-7-16)23(28)31-14-21(27)24-15-8-9-15/h3-7,10-13,15H,8-9,14H2,1-2H3,(H,24,27)