3-methoxy-5-(2-methylpropyl)-6-oxidanylidene-1H-pyrazine-2-carboxylic acid

Systemtic Name: 3-methoxy-5-(2-methylpropyl)-6-oxidanylidene-1H-pyrazine-2-carboxylic acid Openeye Name: 5-isobutyl-3-methoxy-6-oxo-1H-pyrazine-2-carboxylic acid CAS Name: 3-methoxy-5-(2-methylpropyl)-6-oxo-1H-pyrazine-2-carboxylic acid IUPAC Name: 3-methoxy-5-(2-methylpropyl)-6-oxo-1H-pyrazine-2-carboxylic acid Traditional Name: 5-isobutyl-6-keto-3-methoxy-1H-pyrazine-2-carboxylic acid Formula: C10H14N2O4 MolecularWeight: 226.22916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=C(NC1=O)C(=O)O)OC

Isomeric SMILES

CC(C)CC1=NC(=C(NC1=O)C(=O)O)OC

InChI

InChI=1S/C10H14N2O4/c1-5(2)4-6-8(13)12-7(10(14)15)9(11-6)16-3/h5H,4H2,1-3H3,(H,12,13)(H,14,15)