methyl 3-[1-[4-[(2-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: methyl 3-[1-[4-[(2-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: methyl 3-[1-[4-[(2-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-[4-[(2-tert-butylanilino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[4-[(2-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-[4-[(2-tert-butylphenyl)carbamoyl]phenyl]-3,5-dimethyl-pyrazol-4-yl]propionic acid methyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(C)(C)C)C)CCC(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(C)(C)C)C)CCC(=O)OC

InChI

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