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

Systemtic Name: 3-[(3-azanyl-4-methyl-pyrazol-1-yl)methyl]benzoic acid Openeye Name: 3-[(3-amino-4-methyl-pyrazol-1-yl)methyl]benzoic acid CAS Name: 3-[(3-amino-4-methyl-1-pyrazolyl)methyl]benzoic acid IUPAC Name: 3-[(3-amino-4-methylpyrazol-1-yl)methyl]benzoic acid Traditional Name: 3-[(3-amino-4-methyl-pyrazol-1-yl)methyl]benzoic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1N)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CN(N=C1N)CC2=CC=CC(=C2)C(=O)O

InChI

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