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

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(4-bromo-3-methyl-phenyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[(4-bromo-3-methylanilino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(4-bromo-3-methylphenyl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(4-bromo-3-methyl-phenyl)carbamoyl]pyrazinoic acid Formula: C13H10BrN3O3 MolecularWeight: 336.1408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)Br

InChI

InChI=1S/C13H10BrN3O3/c1-7-6-8(2-3-9(7)14)17-12(18)10-11(13(19)20)16-5-4-15-10/h2-6H,1H3,(H,17,18)(H,19,20)