[2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-[4-(butanoylamino)phenyl]-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-oxo-2-[4-(1-oxobutylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(butanoylamino)phenyl]-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(4-butyramidophenyl)-2-keto-ethyl] ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2

InChI

InChI=1S/C17H17N3O4/c1-2-3-16(22)20-13-6-4-12(5-7-13)15(21)11-24-17(23)14-10-18-8-9-19-14/h4-10H,2-3,11H2,1H3,(H,20,22)