[6-[4-(hydroxymethyl)-2-oxidanyl-phenyl]-2-methyl-6-oxidanyl-heptyl] ethanoate

Systemtic Name: [6-[4-(hydroxymethyl)-2-oxidanyl-phenyl]-2-methyl-6-oxidanyl-heptyl] ethanoate Openeye Name: [6-hydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenyl]-2-methyl-heptyl] acetate CAS Name: acetic acid [6-hydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenyl]-2-methylheptyl] ester IUPAC Name: [6-hydroxy-6-[2-hydroxy-4-(hydroxymethyl)phenyl]-2-methylheptyl] acetate Traditional Name: acetic acid [6-hydroxy-6-(2-hydroxy-4-methylol-phenyl)-2-methyl-heptyl] ester Formula: C17H26O5 MolecularWeight: 310.38534

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C1=C(C=C(C=C1)CO)O)O)COC(=O)C

Isomeric SMILES

CC(CCCC(C)(C1=C(C=C(C=C1)CO)O)O)COC(=O)C

InChI

InChI=1S/C17H26O5/c1-12(11-22-13(2)19)5-4-8-17(3,21)15-7-6-14(10-18)9-16(15)20/h6-7,9,12,18,20-21H,4-5,8,10-11H2,1-3H3