(4-methoxyphenyl)methyl 5-methyl-4-oxidanidyl-pyrazin-4-ium-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 5-methyl-4-oxidanidyl-pyrazin-4-ium-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 5-methyl-4-oxido-pyrazin-4-ium-2-carboxylate CAS Name: 5-methyl-4-oxido-2-pyrazin-4-iumcarboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 5-methyl-4-oxidopyrazin-4-ium-2-carboxylate Traditional Name: 5-methyl-4-oxido-pyrazin-4-ium-2-carboxylic acid p-anisyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=[N+]1[O-])C(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CN=C(C=[N+]1[O-])C(=O)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C14H14N2O4/c1-10-7-15-13(8-16(10)18)14(17)20-9-11-3-5-12(19-2)6-4-11/h3-8H,9H2,1-2H3