3-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoyl]pyrazine-2-carboxylate

Systemtic Name: 3-[(4-bromanyl-2,6-dimethyl-phenyl)carbamoyl]pyrazine-2-carboxylate Openeye Name: 3-[(4-bromo-2,6-dimethyl-phenyl)carbamoyl]pyrazine-2-carboxylate CAS Name: 3-[(4-bromo-2,6-dimethylanilino)-oxomethyl]-2-pyrazinecarboxylate IUPAC Name: 3-[(4-bromo-2,6-dimethylphenyl)carbamoyl]pyrazine-2-carboxylate Traditional Name: 3-[(4-bromo-2,6-dimethyl-phenyl)carbamoyl]pyrazinate Formula: C14H11BrN3O3- MolecularWeight: 349.15944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=NC=CN=C2C(=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=NC=CN=C2C(=O)[O-])C)Br

InChI

InChI=1S/C14H12BrN3O3/c1-7-5-9(15)6-8(2)10(7)18-13(19)11-12(14(20)21)17-4-3-16-11/h3-6H,1-2H3,(H,18,19)(H,20,21)/p-1