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

Systemtic Name: [(Z,3S,4S)-3-methyl-4-oxidanyl-dec-1-enyl] benzoate Openeye Name: [(Z,3S,4S)-4-hydroxy-3-methyl-dec-1-enyl] benzoate CAS Name: benzoic acid [(Z,3S,4S)-4-hydroxy-3-methyldec-1-enyl] ester IUPAC Name: [(Z,3S,4S)-4-hydroxy-3-methyldec-1-enyl] benzoate Traditional Name: benzoic acid [(Z,3S,4S)-4-hydroxy-3-methyl-dec-1-enyl] ester Formula: C18H26O3 MolecularWeight: 290.39724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26O3/c1-3-4-5-9-12-17(19)15(2)13-14-21-18(20)16-10-7-6-8-11-16/h6-8,10-11,13-15,17,19H,3-5,9,12H2,1-2H3/b14-13-/t15-,17-/m0/s1