(1S,2R,3S)-2-methoxycarbonyl-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R,3S)-2-methoxycarbonyl-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: (1S,2R,3S)-2-methoxycarbonyl-3-methyl-cyclohexanecarboxylic acid CAS Name: (1S,2R,3S)-2-methoxycarbonyl-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R,3S)-2-methoxycarbonyl-3-methylcyclohexane-1-carboxylic acid Traditional Name: (1S,2R,3S)-2-carbomethoxy-3-methyl-cyclohexanecarboxylic acid Formula: C10H16O4 MolecularWeight: 200.23164

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C(=O)OC)C(=O)O

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C(=O)OC)C(=O)O

InChI

InChI=1S/C10H16O4/c1-6-4-3-5-7(9(11)12)8(6)10(13)14-2/h6-8H,3-5H2,1-2H3,(H,11,12)/t6-,7-,8+/m0/s1