[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-2-[2-(o-tolyl)ethylamino]ethyl] ester Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)COC(=O)C2=NC=CN=C2

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)COC(=O)C2=NC=CN=C2

InChI

InChI=1S/C16H17N3O3/c1-12-4-2-3-5-13(12)6-7-19-15(20)11-22-16(21)14-10-17-8-9-18-14/h2-5,8-10H,6-7,11H2,1H3,(H,19,20)