1-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(2-methylanilino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-(2-methylanilino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(2-methylanilino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(o-toluidino)ethyl]pyrazole-4-carboxylic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C13H13N3O3/c1-9-4-2-3-5-11(9)15-12(17)8-16-7-10(6-14-16)13(18)19/h2-7H,8H2,1H3,(H,15,17)(H,18,19)