phenyl 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate

Systemtic Name: phenyl 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate Openeye Name: phenyl 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)propanoic acid phenyl ester IUPAC Name: phenyl 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propionic acid phenyl ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-15-19(13-14-20(23)24-18-11-7-4-8-12-18)16(2)22(21-15)17-9-5-3-6-10-17/h3-12H,13-14H2,1-2H3