[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] pyrazine-2-carboxylate

Systemtic Name: [(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] pyrazine-2-carboxylate Openeye Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C15H15N3O3 MolecularWeight: 285.2979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C2=NC=CN=C2

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)OC(=O)C2=NC=CN=C2

InChI

InChI=1S/C15H15N3O3/c1-18(2)14(19)13(11-6-4-3-5-7-11)21-15(20)12-10-16-8-9-17-12/h3-10,13H,1-2H3/t13-/m0/s1