[(E)-1-(4-decoxyphenyl)non-2-en-4-yl] benzoate

Systemtic Name: [(E)-1-(4-decoxyphenyl)non-2-en-4-yl] benzoate Openeye Name: 1-[(E)-3-(4-decoxyphenyl)prop-1-enyl]hexyl benzoate CAS Name: benzoic acid [(E)-1-(4-decoxyphenyl)non-2-en-4-yl] ester IUPAC Name: [(E)-1-(4-decoxyphenyl)non-2-en-4-yl] benzoate Traditional Name: benzoic acid [(E)-1-amyl-4-(4-decoxyphenyl)but-2-enyl] ester Formula: C32H46O3 MolecularWeight: 478.70584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)CC=CC(CCCCC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C/C=C/C(CCCCC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C32H46O3/c1-3-5-7-8-9-10-11-16-27-34-30-25-23-28(24-26-30)18-17-22-31(21-13-6-4-2)35-32(33)29-19-14-12-15-20-29/h12,14-15,17,19-20,22-26,31H,3-11,13,16,18,21,27H2,1-2H3/b22-17+