2-methyl-4-(phenethylcarbamoyl)pyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-4-(phenethylcarbamoyl)pyrazole-3-carboxylic acid Openeye Name: 2-methyl-4-(phenethylcarbamoyl)pyrazole-3-carboxylic acid CAS Name: 2-methyl-4-[oxo-(phenethylamino)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-methyl-4-(phenethylcarbamoyl)pyrazole-3-carboxylic acid Traditional Name: 2-methyl-4-(phenethylcarbamoyl)pyrazole-3-carboxylic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H15N3O3/c1-17-12(14(19)20)11(9-16-17)13(18)15-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,15,18)(H,19,20)