4-(5-azanyl-1-phenyl-pyrazol-3-yl)benzoic acid

Systemtic Name: 4-(5-azanyl-1-phenyl-pyrazol-3-yl)benzoic acid Openeye Name: 4-(5-amino-1-phenyl-pyrazol-3-yl)benzoic acid CAS Name: 4-(5-amino-1-phenyl-3-pyrazolyl)benzoic acid IUPAC Name: 4-(5-amino-1-phenylpyrazol-3-yl)benzoic acid Traditional Name: 4-(5-amino-1-phenyl-pyrazol-3-yl)benzoic acid Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O2/c17-15-10-14(11-6-8-12(9-7-11)16(20)21)18-19(15)13-4-2-1-3-5-13/h1-10H,17H2,(H,20,21)