3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyrazine-2-carboxylate

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyrazine-2-carboxylate Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyrazine-2-carboxylate CAS Name: 3-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-2-pyrazinecarboxylate IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]pyrazine-2-carboxylate Traditional Name: 3-(homoveratrylcarbamoyl)pyrazinate Formula: C16H16N3O5- MolecularWeight: 330.31534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NC=CN=C2C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NC=CN=C2C(=O)[O-])OC

InChI

InChI=1S/C16H17N3O5/c1-23-11-4-3-10(9-12(11)24-2)5-6-19-15(20)13-14(16(21)22)18-8-7-17-13/h3-4,7-9H,5-6H2,1-2H3,(H,19,20)(H,21,22)/p-1