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

Systemtic Name: 3-methoxy-6-oxidanylidene-5-(phenylmethyl)-1H-pyrazine-2-carboxylic acid Openeye Name: 5-benzyl-3-methoxy-6-oxo-1H-pyrazine-2-carboxylic acid CAS Name: 3-methoxy-6-oxo-5-(phenylmethyl)-1H-pyrazine-2-carboxylic acid IUPAC Name: 5-benzyl-3-methoxy-6-oxo-1H-pyrazine-2-carboxylic acid Traditional Name: 5-benzyl-6-keto-3-methoxy-1H-pyrazine-2-carboxylic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC(=O)C(=N1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=C(NC(=O)C(=N1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H12N2O4/c1-19-12-10(13(17)18)15-11(16)9(14-12)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,15,16)(H,17,18)