2-(1-naphthalen-2-yl-3-phenyl-pyrazol-4-yl)ethanoic acid

Systemtic Name: 2-(1-naphthalen-2-yl-3-phenyl-pyrazol-4-yl)ethanoic acid Openeye Name: 2-[1-(2-naphthyl)-3-phenyl-pyrazol-4-yl]acetic acid CAS Name: 2-[1-(2-naphthalenyl)-3-phenyl-4-pyrazolyl]acetic acid IUPAC Name: 2-(1-naphthalen-2-yl-3-phenylpyrazol-4-yl)acetic acid Traditional Name: 2-[1-(2-naphthyl)-3-phenyl-pyrazol-4-yl]acetic acid Formula: C21H16N2O2 MolecularWeight: 328.36394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CC(=O)O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CC(=O)O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16N2O2/c24-20(25)13-18-14-23(22-21(18)16-7-2-1-3-8-16)19-11-10-15-6-4-5-9-17(15)12-19/h1-12,14H,13H2,(H,24,25)