3-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methyl-benzoic acid

Systemtic Name: 3-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methyl-benzoic acid Openeye Name: 3-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methyl-benzoic acid CAS Name: 3-[(1,3-dimethyl-4-pyrazolyl)methylamino]-2-methylbenzoic acid IUPAC Name: 3-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylbenzoic acid Traditional Name: 3-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methyl-benzoic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CN(N=C2C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CN(N=C2C)C)C(=O)O

InChI

InChI=1S/C14H17N3O2/c1-9-12(14(18)19)5-4-6-13(9)15-7-11-8-17(3)16-10(11)2/h4-6,8,15H,7H2,1-3H3,(H,18,19)