methyl 2-[3-(ethanoylsulfanylmethyl)-2-oxidanylidene-azocan-1-yl]propanoate

Systemtic Name: methyl 2-[3-(ethanoylsulfanylmethyl)-2-oxidanylidene-azocan-1-yl]propanoate Openeye Name: methyl 2-[3-(acetylsulfanylmethyl)-2-oxo-azocan-1-yl]propanoate CAS Name: 2-[3-[(acetylthio)methyl]-2-oxo-1-azocanyl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(acetylsulfanylmethyl)-2-oxoazocan-1-yl]propanoate Traditional Name: 2-[3-[(acetylthio)methyl]-2-keto-azocan-1-yl]propionic acid methyl ester Formula: C14H23NO4S MolecularWeight: 301.40172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1CCCCCC(C1=O)CSC(=O)C

Isomeric SMILES

CC(C(=O)OC)N1CCCCCC(C1=O)CSC(=O)C

InChI

InChI=1S/C14H23NO4S/c1-10(14(18)19-3)15-8-6-4-5-7-12(13(15)17)9-20-11(2)16/h10,12H,4-9H2,1-3H3