[1-[2-(4-hydroxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] butanoate

Systemtic Name: [1-[2-(4-hydroxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] butanoate Openeye Name: [1-[2-(4-hydroxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] butanoate CAS Name: butanoic acid [1-[2-(4-hydroxyphenyl)ethyl]-3-phenyl-4-pyrazolyl] ester IUPAC Name: [1-[2-(4-hydroxyphenyl)ethyl]-3-phenylpyrazol-4-yl] butanoate Traditional Name: butyric acid [1-[2-(4-hydroxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CN(N=C1C2=CC=CC=C2)CCC3=CC=C(C=C3)O

Isomeric SMILES

CCCC(=O)OC1=CN(N=C1C2=CC=CC=C2)CCC3=CC=C(C=C3)O

InChI

InChI=1S/C21H22N2O3/c1-2-6-20(25)26-19-15-23(14-13-16-9-11-18(24)12-10-16)22-21(19)17-7-4-3-5-8-17/h3-5,7-12,15,24H,2,6,13-14H2,1H3