[2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3-phenylpropanoate

Systemtic Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3-phenylpropanoate Openeye Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2-(2,3-dimethylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-phenylpyrazol-3-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C26H24N2O2 MolecularWeight: 396.48096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)CCC4=CC=CC=C4)C

InChI

InChI=1S/C26H24N2O2/c1-19-10-9-15-24(20(19)2)28-25(18-23(27-28)22-13-7-4-8-14-22)30-26(29)17-16-21-11-5-3-6-12-21/h3-15,18H,16-17H2,1-2H3