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

Systemtic Name: 2-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Openeye Name: 2-[(1-methylpyrazol-4-yl)methylamino]benzoic acid CAS Name: 2-[(1-methyl-4-pyrazolyl)methylamino]benzoic acid IUPAC Name: 2-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Traditional Name: 2-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2=CC=CC=C2C(=O)O

Isomeric SMILES

CN1C=C(C=N1)CNC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C12H13N3O2/c1-15-8-9(7-14-15)6-13-11-5-3-2-4-10(11)12(16)17/h2-5,7-8,13H,6H2,1H3,(H,16,17)