methyl (E)-6-[3-[(E)-1-oxidanylnon-3-enyl]phenyl]hex-5-enoate

Systemtic Name: methyl (E)-6-[3-[(E)-1-oxidanylnon-3-enyl]phenyl]hex-5-enoate Openeye Name: methyl (E)-6-[3-[(E)-1-hydroxynon-3-enyl]phenyl]hex-5-enoate CAS Name: (E)-6-[3-[(E)-1-hydroxynon-3-enyl]phenyl]-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-[3-[(E)-1-hydroxynon-3-enyl]phenyl]hex-5-enoate Traditional Name: (E)-6-[3-[(E)-1-hydroxynon-3-enyl]phenyl]hex-5-enoic acid methyl ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC(C1=CC=CC(=C1)C=CCCCC(=O)OC)O

Isomeric SMILES

CCCCC/C=C/CC(C1=CC=CC(=C1)/C=C/CCCC(=O)OC)O

InChI

InChI=1S/C22H32O3/c1-3-4-5-6-7-10-16-21(23)20-15-12-14-19(18-20)13-9-8-11-17-22(24)25-2/h7,9-10,12-15,18,21,23H,3-6,8,11,16-17H2,1-2H3/b10-7+,13-9+