1-[dithiocarboxy(6-methylheptyl)amino]-6-methyl-2-oxidanylidene-heptane-1-sulfonic acid

Systemtic Name: 1-[dithiocarboxy(6-methylheptyl)amino]-6-methyl-2-oxidanylidene-heptane-1-sulfonic acid Openeye Name: 1-[dithiocarboxy(6-methylheptyl)amino]-6-methyl-2-oxo-heptane-1-sulfonic acid CAS Name: 1-[dithiocarboxy(6-methylheptyl)amino]-6-methyl-2-oxo-1-heptanesulfonic acid IUPAC Name: 1-[dithiocarboxy(6-methylheptyl)amino]-6-methyl-2-oxoheptane-1-sulfonic acid Traditional Name: 1-[dithiocarboxy(6-methylheptyl)amino]-2-keto-6-methyl-heptane-1-sulfonic acid Formula: C17H33NO4S3 MolecularWeight: 411.64322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCN(C(C(=O)CCCC(C)C)S(=O)(=O)O)C(=S)S

Isomeric SMILES

CC(C)CCCCCN(C(C(=O)CCCC(C)C)S(=O)(=O)O)C(=S)S

InChI

InChI=1S/C17H33NO4S3/c1-13(2)9-6-5-7-12-18(17(23)24)16(25(20,21)22)15(19)11-8-10-14(3)4/h13-14,16H,5-12H2,1-4H3,(H,23,24)(H,20,21,22)