3-[(3-chloranyl-4-methyl-phenyl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(3-chloranyl-4-methyl-phenyl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(3-chloro-4-methyl-phenyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[(3-chloro-4-methylanilino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(3-chloro-4-methylphenyl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(3-chloro-4-methyl-phenyl)carbamoyl]pyrazinoic acid Formula: C13H10ClN3O3 MolecularWeight: 291.6898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC=CN=C2C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC=CN=C2C(=O)O)Cl

InChI

InChI=1S/C13H10ClN3O3/c1-7-2-3-8(6-9(7)14)17-12(18)10-11(13(19)20)16-5-4-15-10/h2-6H,1H3,(H,17,18)(H,19,20)