ethyl 9-(ethanoylsulfanylmethyl)-10-oxidanylidene-azecane-2-carboxylate

Systemtic Name: ethyl 9-(ethanoylsulfanylmethyl)-10-oxidanylidene-azecane-2-carboxylate Openeye Name: ethyl 9-(acetylsulfanylmethyl)-10-oxo-azecane-2-carboxylate CAS Name: 9-[(acetylthio)methyl]-10-oxo-2-azecanecarboxylic acid ethyl ester IUPAC Name: ethyl 9-(acetylsulfanylmethyl)-10-oxoazecane-2-carboxylate Traditional Name: 9-[(acetylthio)methyl]-10-keto-azecane-2-carboxylic acid ethyl ester Formula: C15H25NO4S MolecularWeight: 315.4283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCCCC(C(=O)N1)CSC(=O)C

Isomeric SMILES

CCOC(=O)C1CCCCCCC(C(=O)N1)CSC(=O)C

InChI

InChI=1S/C15H25NO4S/c1-3-20-15(19)13-9-7-5-4-6-8-12(14(18)16-13)10-21-11(2)17/h12-13H,3-10H2,1-2H3,(H,16,18)