2-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4,6-diketo-2,2-dimethyl-1,3-dioxan-5-ylidene)methylamino]-4-(methylthio)butyric acid Formula: C12H17NO6S MolecularWeight: 303.33148

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC(CCSC)C(=O)O)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC(CCSC)C(=O)O)C(=O)O1)C

InChI

InChI=1S/C12H17NO6S/c1-12(2)18-10(16)7(11(17)19-12)6-13-8(9(14)15)4-5-20-3/h6,8,13H,4-5H2,1-3H3,(H,14,15)