2-(1-sulfanyldodecyl)butanedioic acid

Systemtic Name: 2-(1-sulfanyldodecyl)butanedioic acid Openeye Name: 2-(1-sulfanyldodecyl)butanedioic acid CAS Name: 2-(1-mercaptododecyl)butanedioic acid IUPAC Name: 2-(1-sulfanyldodecyl)butanedioic acid Traditional Name: 2-(1-mercaptododecyl)succinic acid Formula: C16H30O4S MolecularWeight: 318.472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(CC(=O)O)C(=O)O)S

Isomeric SMILES

CCCCCCCCCCCC(C(CC(=O)O)C(=O)O)S

InChI

InChI=1S/C16H30O4S/c1-2-3-4-5-6-7-8-9-10-11-14(21)13(16(19)20)12-15(17)18/h13-14,21H,2-12H2,1H3,(H,17,18)(H,19,20)