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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2=CC=C(C=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

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