[(Z,3S,4R)-3-methyl-4-oxidanyl-oct-1-enyl] benzoate

Systemtic Name: [(Z,3S,4R)-3-methyl-4-oxidanyl-oct-1-enyl] benzoate Openeye Name: [(Z,3S,4R)-4-hydroxy-3-methyl-oct-1-enyl] benzoate CAS Name: benzoic acid [(Z,3S,4R)-4-hydroxy-3-methyloct-1-enyl] ester IUPAC Name: [(Z,3S,4R)-4-hydroxy-3-methyloct-1-enyl] benzoate Traditional Name: benzoic acid [(Z,3S,4R)-4-hydroxy-3-methyl-oct-1-enyl] ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)C=COC(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCCC[C@H]([C@@H](C)/C=C\OC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C16H22O3/c1-3-4-10-15(17)13(2)11-12-19-16(18)14-8-6-5-7-9-14/h5-9,11-13,15,17H,3-4,10H2,1-2H3/b12-11-/t13-,15+/m0/s1