ethyl 1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-5-pentan-3-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-5-pentan-3-yl-pyrazole-3-carboxylate Openeye Name: ethyl 1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-5-(1-ethylpropyl)pyrazole-3-carboxylate CAS Name: 1-[4-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]phenyl]-5-pentan-3-yl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-5-pentan-3-ylpyrazole-3-carboxylate Traditional Name: 5-(1-ethylpropyl)-1-[4-(homoveratrylcarbamoyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C(=O)OCC

Isomeric SMILES

CCC(CC)C1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C(=O)OCC

InChI

InChI=1S/C28H35N3O5/c1-6-20(7-2)24-18-23(28(33)36-8-3)30-31(24)22-12-10-21(11-13-22)27(32)29-16-15-19-9-14-25(34-4)26(17-19)35-5/h9-14,17-18,20H,6-8,15-16H2,1-5H3,(H,29,32)