5-(4-butoxyphenyl)pyrazine-2-carboxylate

Systemtic Name: 5-(4-butoxyphenyl)pyrazine-2-carboxylate Openeye Name: 5-(4-butoxyphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-butoxyphenyl)-2-pyrazinecarboxylate IUPAC Name: 5-(4-butoxyphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-butoxyphenyl)pyrazinate Formula: C15H15N2O3- MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C15H16N2O3/c1-2-3-8-20-12-6-4-11(5-7-12)13-9-17-14(10-16-13)15(18)19/h4-7,9-10H,2-3,8H2,1H3,(H,18,19)/p-1