methyl 3-[1-[4-[(4-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: methyl 3-[1-[4-[(4-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: methyl 3-[1-[4-[(4-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-[4-[(4-tert-butylanilino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[4-[(4-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-[4-[(4-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propionic acid methyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C)C)CCC(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C)C)CCC(=O)OC

InChI

InChI=1S/C26H31N3O3/c1-17-23(15-16-24(30)32-6)18(2)29(28-17)22-13-7-19(8-14-22)25(31)27-21-11-9-20(10-12-21)26(3,4)5/h7-14H,15-16H2,1-6H3,(H,27,31)