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

Systemtic Name: ethyl 5-butan-2-yl-1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-5-sec-butyl-pyrazole-3-carboxylate CAS Name: 5-butan-2-yl-1-[4-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-butan-2-yl-1-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]pyrazole-3-carboxylate Traditional Name: 1-[4-(homoveratrylcarbamoyl)phenyl]-5-sec-butyl-pyrazole-3-carboxylic acid ethyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N3O5/c1-6-18(3)23-17-22(27(32)35-7-2)29-30(23)21-11-9-20(10-12-21)26(31)28-15-14-19-8-13-24(33-4)25(16-19)34-5/h8-13,16-18H,6-7,14-15H2,1-5H3,(H,28,31)