2-[(1-phenylpyrazol-4-yl)methylamino]benzoic acid

Systemtic Name: 2-[(1-phenylpyrazol-4-yl)methylamino]benzoic acid Openeye Name: 2-[(1-phenylpyrazol-4-yl)methylamino]benzoic acid CAS Name: 2-[(1-phenyl-4-pyrazolyl)methylamino]benzoic acid IUPAC Name: 2-[(1-phenylpyrazol-4-yl)methylamino]benzoic acid Traditional Name: 2-[(1-phenylpyrazol-4-yl)methylamino]benzoic acid Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H15N3O2/c21-17(22)15-8-4-5-9-16(15)18-10-13-11-19-20(12-13)14-6-2-1-3-7-14/h1-9,11-12,18H,10H2,(H,21,22)