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methyl 2-methyl-6-[(1R,3S)-3-oxidanylcyclohexyl]carbonyl-benzoate

methyl 2-methyl-6-[(1R,3S)-3-oxidanylcyclohexyl]carbonyl-benzoate

Systemtic Name:methyl 2-methyl-6-[(1R,3S)-3-oxidanylcyclohexyl]carbonyl-benzoate
Openeye Name:methyl 2-[(1R,3S)-3-hydroxycyclohexanecarbonyl]-6-methyl-benzoate
CAS Name:2-[[(1R,3S)-3-hydroxycyclohexyl]-oxomethyl]-6-methylbenzoic acid methyl ester
IUPAC Name:methyl 2-[(1R,3S)-3-hydroxycyclohexanecarbonyl]-6-methylbenzoate
Traditional Name:2-[(1R,3S)-3-hydroxycyclohexanecarbonyl]-6-methyl-benzoic acid methyl ester
Formula: C16H20O4
MolecularWeight: 276.3276
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C(=O)OC)C(=O)C2CCCC(C2)O


Isomeric SMILES

CC1=CC=CC(=C1C(=O)OC)C(=O)[C@@H]2CCC[C@@H](C2)O


InChI

InChI=1S/C16H20O4/c1-10-5-3-8-13(14(10)16(19)20-2)15(18)11-6-4-7-12(17)9-11/h3,5,8,11-12,17H,4,6-7,9H2,1-2H3/t11-,12+/m1/s1


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