4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid

Systemtic Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid Openeye Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid CAS Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid IUPAC Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid Traditional Name: 4-[3-(4-chlorophenyl)-2-pyrazolin-1-yl]benzoic acid Formula: C16H13ClN2O2 MolecularWeight: 300.73962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13ClN2O2/c17-13-5-1-11(2-6-13)15-9-10-19(18-15)14-7-3-12(4-8-14)16(20)21/h1-8H,9-10H2,(H,20,21)