methyl (9Z,11E,13S)-13-oxidanyl-15-phenyl-pentadeca-9,11-dienoate

Systemtic Name: methyl (9Z,11E,13S)-13-oxidanyl-15-phenyl-pentadeca-9,11-dienoate Openeye Name: methyl (9Z,11E,13S)-13-hydroxy-15-phenyl-pentadeca-9,11-dienoate CAS Name: (9Z,11E,13S)-13-hydroxy-15-phenylpentadeca-9,11-dienoic acid methyl ester IUPAC Name: methyl (9Z,11E,13S)-13-hydroxy-15-phenylpentadeca-9,11-dienoate Traditional Name: (9Z,11E,13S)-13-hydroxy-15-phenyl-pentadeca-9,11-dienoic acid methyl ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCC=CC=CC(CCC1=CC=CC=C1)O

Isomeric SMILES

COC(=O)CCCCCCC/C=C\C=C\[C@H](CCC1=CC=CC=C1)O

InChI

InChI=1S/C22H32O3/c1-25-22(24)17-13-8-6-4-2-3-5-7-12-16-21(23)19-18-20-14-10-9-11-15-20/h5,7,9-12,14-16,21,23H,2-4,6,8,13,17-19H2,1H3/b7-5-,16-12+/t21-/m1/s1