tert-butyl 2-[10-(ethanoylsulfanylmethyl)-2-oxidanylidene-azecan-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[10-(ethanoylsulfanylmethyl)-2-oxidanylidene-azecan-3-yl]ethanoate Openeye Name: tert-butyl 2-[10-(acetylsulfanylmethyl)-2-oxo-azecan-3-yl]acetate CAS Name: 2-[10-[(acetylthio)methyl]-2-oxo-3-azecanyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[10-(acetylsulfanylmethyl)-2-oxoazecan-3-yl]acetate Traditional Name: 2-[10-[(acetylthio)methyl]-2-keto-azecan-3-yl]acetic acid tert-butyl ester Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCCCCCC(C(=O)N1)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCC1CCCCCCC(C(=O)N1)CC(=O)OC(C)(C)C

InChI

InChI=1S/C18H31NO4S/c1-13(20)24-12-15-10-8-6-5-7-9-14(17(22)19-15)11-16(21)23-18(2,3)4/h14-15H,5-12H2,1-4H3,(H,19,22)