4-methyl-4-(1-sulfanylethyl)heptanedioic acid

Systemtic Name: 4-methyl-4-(1-sulfanylethyl)heptanedioic acid Openeye Name: 4-methyl-4-(1-sulfanylethyl)heptanedioic acid CAS Name: 4-(1-mercaptoethyl)-4-methylheptanedioic acid IUPAC Name: 4-methyl-4-(1-sulfanylethyl)heptanedioic acid Traditional Name: 4-(1-mercaptoethyl)-4-methyl-pimelic acid Formula: C10H18O4S MolecularWeight: 234.31252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(CCC(=O)O)CCC(=O)O)S

Isomeric SMILES

CC(C(C)(CCC(=O)O)CCC(=O)O)S

InChI

InChI=1S/C10H18O4S/c1-7(15)10(2,5-3-8(11)12)6-4-9(13)14/h7,15H,3-6H2,1-2H3,(H,11,12)(H,13,14)