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

Systemtic Name: 3-methyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Openeye Name: 3-methyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoic acid CAS Name: 3-methyl-4-[(1-methyl-4-pyrazolyl)methylamino]benzoic acid IUPAC Name: 3-methyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Traditional Name: 3-methyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NCC2=CN(N=C2)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NCC2=CN(N=C2)C

InChI

InChI=1S/C13H15N3O2/c1-9-5-11(13(17)18)3-4-12(9)14-6-10-7-15-16(2)8-10/h3-5,7-8,14H,6H2,1-2H3,(H,17,18)