3-[5-azanyl-3-(4-chlorophenyl)pyrazol-1-yl]benzoic acid

Systemtic Name: 3-[5-azanyl-3-(4-chlorophenyl)pyrazol-1-yl]benzoic acid Openeye Name: 3-[5-amino-3-(4-chlorophenyl)pyrazol-1-yl]benzoic acid CAS Name: 3-[5-amino-3-(4-chlorophenyl)-1-pyrazolyl]benzoic acid IUPAC Name: 3-[5-amino-3-(4-chlorophenyl)pyrazol-1-yl]benzoic acid Traditional Name: 3-[5-amino-3-(4-chlorophenyl)pyrazol-1-yl]benzoic acid Formula: C16H12ClN3O2 MolecularWeight: 313.73838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)N)C(=O)O

InChI

InChI=1S/C16H12ClN3O2/c17-12-6-4-10(5-7-12)14-9-15(18)20(19-14)13-3-1-2-11(8-13)16(21)22/h1-9H,18H2,(H,21,22)