O1-methyl O3-sulfo 1-methylcyclohexane-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-sulfo 1-methylcyclohexane-1,3-dicarboxylate Openeye Name: O1-methyl O3-sulfo 1-methylcyclohexane-1,3-dicarboxylate CAS Name: 1-methylcyclohexane-1,3-dicarboxylic acid O1-methyl ester O3-sulfo ester IUPAC Name: 1-O-methyl 3-O-sulfo 1-methylcyclohexane-1,3-dicarboxylate Traditional Name: 1-methylcyclohexane-1,3-dicarboxylic acid O1-methyl ester O3-sulfo ester Formula: C10H16O7S MolecularWeight: 280.29484

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1)C(=O)OS(=O)(=O)O)C(=O)OC

Isomeric SMILES

CC1(CCCC(C1)C(=O)OS(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C10H16O7S/c1-10(9(12)16-2)5-3-4-7(6-10)8(11)17-18(13,14)15/h7H,3-6H2,1-2H3,(H,13,14,15)