[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] ester Formula: C15H17N3O3 MolecularWeight: 287.31378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C15H17N3O3/c1-9-6-17-13(7-16-9)15(20)21-8-14(19)12-5-10(2)18(4)11(12)3/h5-7H,8H2,1-4H3