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

Systemtic Name: 3-[(1-ethyl-3-methyl-pyrazol-4-yl)methylamino]-4-methyl-benzoic acid Openeye Name: 3-[(1-ethyl-3-methyl-pyrazol-4-yl)methylamino]-4-methyl-benzoic acid CAS Name: 3-[(1-ethyl-3-methyl-4-pyrazolyl)methylamino]-4-methylbenzoic acid IUPAC Name: 3-[(1-ethyl-3-methylpyrazol-4-yl)methylamino]-4-methylbenzoic acid Traditional Name: 3-[(1-ethyl-3-methyl-pyrazol-4-yl)methylamino]-4-methyl-benzoic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNC2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCN1C=C(C(=N1)C)CNC2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C15H19N3O2/c1-4-18-9-13(11(3)17-18)8-16-14-7-12(15(19)20)6-5-10(14)2/h5-7,9,16H,4,8H2,1-3H3,(H,19,20)