4-[(3-azanylpyrazol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(3-azanylpyrazol-1-yl)methyl]benzoic acid Openeye Name: 4-[(3-aminopyrazol-1-yl)methyl]benzoic acid CAS Name: 4-[(3-amino-1-pyrazolyl)methyl]benzoic acid IUPAC Name: 4-[(3-aminopyrazol-1-yl)methyl]benzoic acid Traditional Name: 4-[(3-aminopyrazol-1-yl)methyl]benzoic acid Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=N2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=N2)N)C(=O)O

InChI

InChI=1S/C11H11N3O2/c12-10-5-6-14(13-10)7-8-1-3-9(4-2-8)11(15)16/h1-6H,7H2,(H2,12,13)(H,15,16)