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

Systemtic Name: [2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-acetamidopropanoate Openeye Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid [2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid [2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] ester Formula: C14H20N2O4 MolecularWeight: 280.3196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC(=O)CCNC(=O)C

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC(=O)CCNC(=O)C

InChI

InChI=1S/C14H20N2O4/c1-9-7-12(10(2)16(9)4)13(18)8-20-14(19)5-6-15-11(3)17/h7H,5-6,8H2,1-4H3,(H,15,17)