2-chloranyl-2-[2-(3,3-dimethylbutanethioylsulfanyl)-4-oxidanylidene-azetidin-1-yl]ethanoic acid

Systemtic Name: 2-chloranyl-2-[2-(3,3-dimethylbutanethioylsulfanyl)-4-oxidanylidene-azetidin-1-yl]ethanoic acid Openeye Name: 2-chloro-2-[2-(3,3-dimethylbutanethioylsulfanyl)-4-oxo-azetidin-1-yl]acetic acid CAS Name: 2-chloro-2-[2-[(3,3-dimethyl-1-sulfanylidenebutyl)thio]-4-oxo-1-azetidinyl]acetic acid IUPAC Name: 2-chloro-2-[2-(3,3-dimethylbutanethioylsulfanyl)-4-oxoazetidin-1-yl]acetic acid Traditional Name: 2-chloro-2-[2-(3,3-dimethylbutanethioylthio)-4-keto-azetidin-1-yl]acetic acid Formula: C11H16ClNO3S2 MolecularWeight: 309.83264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=S)SC1CC(=O)N1C(C(=O)O)Cl

Isomeric SMILES

CC(C)(C)CC(=S)SC1CC(=O)N1C(C(=O)O)Cl

InChI

InChI=1S/C11H16ClNO3S2/c1-11(2,3)5-8(17)18-7-4-6(14)13(7)9(12)10(15)16/h7,9H,4-5H2,1-3H3,(H,15,16)