2-ethyl-4-[(4-methylphenyl)methylamino]pyrazole-3-carboxylic acid

Systemtic Name: 2-ethyl-4-[(4-methylphenyl)methylamino]pyrazole-3-carboxylic acid Openeye Name: 2-ethyl-4-(p-tolylmethylamino)pyrazole-3-carboxylic acid CAS Name: 2-ethyl-4-[(4-methylphenyl)methylamino]-3-pyrazolecarboxylic acid IUPAC Name: 2-ethyl-4-[(4-methylphenyl)methylamino]pyrazole-3-carboxylic acid Traditional Name: 2-ethyl-4-[(4-methylbenzyl)amino]pyrazole-3-carboxylic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NCC2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

CCN1C(=C(C=N1)NCC2=CC=C(C=C2)C)C(=O)O

InChI

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