[3-(hydroxymethyl)-5-methyl-3-oxidanyl-cyclohexyl] benzoate

Systemtic Name: [3-(hydroxymethyl)-5-methyl-3-oxidanyl-cyclohexyl] benzoate Openeye Name: [3-hydroxy-3-(hydroxymethyl)-5-methyl-cyclohexyl] benzoate CAS Name: benzoic acid [3-hydroxy-3-(hydroxymethyl)-5-methylcyclohexyl] ester IUPAC Name: [3-hydroxy-3-(hydroxymethyl)-5-methylcyclohexyl] benzoate Traditional Name: benzoic acid (3-hydroxy-5-methyl-3-methylol-cyclohexyl) ester Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(CO)O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CC(CC(C1)(CO)O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H20O4/c1-11-7-13(9-15(18,8-11)10-16)19-14(17)12-5-3-2-4-6-12/h2-6,11,13,16,18H,7-10H2,1H3