3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-methyl-propanoic acid

Systemtic Name: 3-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-methyl-propanoic acid Openeye Name: 3-[(1,1-dioxothian-4-yl)amino]-2-methyl-propanoic acid CAS Name: 3-[(1,1-dioxo-4-thianyl)amino]-2-methylpropanoic acid IUPAC Name: 3-[(1,1-dioxothian-4-yl)amino]-2-methylpropanoic acid Traditional Name: 3-[(1,1-diketothian-4-yl)amino]-2-methyl-propionic acid Formula: C9H17NO4S MolecularWeight: 235.30058

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1CCS(=O)(=O)CC1)C(=O)O

Isomeric SMILES

CC(CNC1CCS(=O)(=O)CC1)C(=O)O

InChI

InChI=1S/C9H17NO4S/c1-7(9(11)12)6-10-8-2-4-15(13,14)5-3-8/h7-8,10H,2-6H2,1H3,(H,11,12)