3-(3-methyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)propanoic acid

Systemtic Name: 3-(3-methyl-5-oxidanylidene-1,2-diphenyl-pyrazol-4-yl)propanoic acid Openeye Name: 3-(3-methyl-5-oxo-1,2-diphenyl-pyrazol-4-yl)propanoic acid CAS Name: 3-(3-methyl-5-oxo-1,2-diphenyl-4-pyrazolyl)propanoic acid IUPAC Name: 3-(3-methyl-5-oxo-1,2-diphenylpyrazol-4-yl)propanoic acid Traditional Name: 3-(3-keto-5-methyl-1,2-diphenyl-3-pyrazolin-4-yl)propionic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C2=CC=CC=C2)C3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1C2=CC=CC=C2)C3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C19H18N2O3/c1-14-17(12-13-18(22)23)19(24)21(16-10-6-3-7-11-16)20(14)15-8-4-2-5-9-15/h2-11H,12-13H2,1H3,(H,22,23)