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

Systemtic Name: 4-[5-azanyl-4-(3-chlorophenyl)pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-amino-4-(3-chlorophenyl)pyrazol-1-yl]benzoic acid CAS Name: 4-[5-amino-4-(3-chlorophenyl)-1-pyrazolyl]benzoic acid IUPAC Name: 4-[5-amino-4-(3-chlorophenyl)pyrazol-1-yl]benzoic acid Traditional Name: 4-[5-amino-4-(3-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)Cl)C2=C(N(N=C2)C3=CC=C(C=C3)C(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=C(N(N=C2)C3=CC=C(C=C3)C(=O)O)N

InChI

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