methyl (E)-6-(4-octylphenyl)hex-5-enoate

Systemtic Name: methyl (E)-6-(4-octylphenyl)hex-5-enoate Openeye Name: methyl (E)-6-(4-octylphenyl)hex-5-enoate CAS Name: (E)-6-(4-octylphenyl)-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-(4-octylphenyl)hex-5-enoate Traditional Name: (E)-6-(4-octylphenyl)hex-5-enoic acid methyl ester Formula: C21H32O2 MolecularWeight: 316.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C=CCCCC(=O)OC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)/C=C/CCCC(=O)OC

InChI

InChI=1S/C21H32O2/c1-3-4-5-6-7-9-12-19-15-17-20(18-16-19)13-10-8-11-14-21(22)23-2/h10,13,15-18H,3-9,11-12,14H2,1-2H3/b13-10+