octanoyl 3-methyl-4-oxidanyl-benzoate

Systemtic Name: octanoyl 3-methyl-4-oxidanyl-benzoate Openeye Name: octanoyl 4-hydroxy-3-methyl-benzoate CAS Name: 4-hydroxy-3-methylbenzoic acid 1-oxooctyl ester IUPAC Name: octanoyl 4-hydroxy-3-methylbenzoate Traditional Name: 4-hydroxy-3-methyl-benzoic acid caprylyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(=O)C1=CC(=C(C=C1)O)C

Isomeric SMILES

CCCCCCCC(=O)OC(=O)C1=CC(=C(C=C1)O)C

InChI

InChI=1S/C16H22O4/c1-3-4-5-6-7-8-15(18)20-16(19)13-9-10-14(17)12(2)11-13/h9-11,17H,3-8H2,1-2H3