methyl (1R,2S,3R)-5,5-dimethyl-2-oxidanyl-3-(phenylmethoxymethyl)cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2S,3R)-5,5-dimethyl-2-oxidanyl-3-(phenylmethoxymethyl)cyclohexane-1-carboxylate Openeye Name: methyl (1R,2S,3R)-3-(benzyloxymethyl)-2-hydroxy-5,5-dimethyl-cyclohexanecarboxylate CAS Name: (1R,2S,3R)-2-hydroxy-5,5-dimethyl-3-(phenylmethoxymethyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S,3R)-2-hydroxy-5,5-dimethyl-3-(phenylmethoxymethyl)cyclohexane-1-carboxylate Traditional Name: (1R,2S,3R)-3-(benzoxymethyl)-2-hydroxy-5,5-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C18H26O4 MolecularWeight: 306.39664

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(C(C1)C(=O)OC)O)COCC2=CC=CC=C2)C

Isomeric SMILES

CC1(C[C@@H]([C@@H]([C@@H](C1)C(=O)OC)O)COCC2=CC=CC=C2)C

InChI

InChI=1S/C18H26O4/c1-18(2)9-14(16(19)15(10-18)17(20)21-3)12-22-11-13-7-5-4-6-8-13/h4-8,14-16,19H,9-12H2,1-3H3/t14-,15-,16+/m1/s1