6-chloranyl-5-methyl-4-(3-methylphenyl)-3-oxidanylidene-pyrazine-2-carboxylic acid

Systemtic Name: 6-chloranyl-5-methyl-4-(3-methylphenyl)-3-oxidanylidene-pyrazine-2-carboxylic acid Openeye Name: 6-chloro-5-methyl-4-(m-tolyl)-3-oxo-pyrazine-2-carboxylic acid CAS Name: 6-chloro-5-methyl-4-(3-methylphenyl)-3-oxo-2-pyrazinecarboxylic acid IUPAC Name: 6-chloro-5-methyl-4-(3-methylphenyl)-3-oxopyrazine-2-carboxylic acid Traditional Name: 6-chloro-3-keto-5-methyl-4-(m-tolyl)pyrazinoic acid Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(N=C(C2=O)C(=O)O)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(N=C(C2=O)C(=O)O)Cl)C

InChI

InChI=1S/C13H11ClN2O3/c1-7-4-3-5-9(6-7)16-8(2)11(14)15-10(12(16)17)13(18)19/h3-6H,1-2H3,(H,18,19)