3-(butan-2-ylcarbamoyl)pyrazine-2-carboxylic acid

Systemtic Name: 3-(butan-2-ylcarbamoyl)pyrazine-2-carboxylic acid Openeye Name: 3-(sec-butylcarbamoyl)pyrazine-2-carboxylic acid CAS Name: 3-[(butan-2-ylamino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-(butan-2-ylcarbamoyl)pyrazine-2-carboxylic acid Traditional Name: 3-(sec-butylcarbamoyl)pyrazinoic acid Formula: C10H13N3O3 MolecularWeight: 223.22852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=NC=CN=C1C(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1=NC=CN=C1C(=O)O

InChI

InChI=1S/C10H13N3O3/c1-3-6(2)13-9(14)7-8(10(15)16)12-5-4-11-7/h4-6H,3H2,1-2H3,(H,13,14)(H,15,16)