[2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] pyrazine-2-carboxylate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)phenyl]ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)C3=NC=CN=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H19N3O5S/c22-17(13-26-18(23)16-12-19-8-9-20-16)14-4-6-15(7-5-14)27(24,25)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11,13H2