(3S)-3-aminocarbonyl-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylic acid

Systemtic Name: (3S)-3-aminocarbonyl-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylic acid Openeye Name: (3S)-3-carbamoyl-2-(p-tolyl)-3,4-dihydropyrazole-5-carboxylic acid CAS Name: (3S)-3-carbamoyl-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylic acid IUPAC Name: (3S)-3-carbamoyl-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylic acid Traditional Name: (5S)-5-carbamoyl-1-(p-tolyl)-2-pyrazoline-3-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(CC(=N2)C(=O)O)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H](CC(=N2)C(=O)O)C(=O)N

InChI

InChI=1S/C12H13N3O3/c1-7-2-4-8(5-3-7)15-10(11(13)16)6-9(14-15)12(17)18/h2-5,10H,6H2,1H3,(H2,13,16)(H,17,18)/t10-/m0/s1