[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C16H16ClN3O3 MolecularWeight: 333.76954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)NC(C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)N[C@H](C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClN3O3/c1-10-7-19-14(8-18-10)16(22)23-9-15(21)20-11(2)12-3-5-13(17)6-4-12/h3-8,11H,9H2,1-2H3,(H,20,21)/t11-/m1/s1