5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[2-cyanoethyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)N(C)CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)N(C)CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C15H16N4O2/c1-11-13(15(20)21)14(18(2)10-6-9-16)19(17-11)12-7-4-3-5-8-12/h3-5,7-8H,6,10H2,1-2H3,(H,20,21)