[1-oxidanylidene-1-(4-prop-2-enoxyphenyl)propan-2-yl] 4-heptylbenzoate

Systemtic Name: [1-oxidanylidene-1-(4-prop-2-enoxyphenyl)propan-2-yl] 4-heptylbenzoate Openeye Name: [2-(4-allyloxyphenyl)-1-methyl-2-oxo-ethyl] 4-heptylbenzoate CAS Name: 4-heptylbenzoic acid [1-oxo-1-(4-prop-2-enoxyphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-prop-2-enoxyphenyl)propan-2-yl] 4-heptylbenzoate Traditional Name: 4-heptylbenzoic acid [2-(4-allyloxyphenyl)-2-keto-1-methyl-ethyl] ester Formula: C26H32O4 MolecularWeight: 408.52988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)OCC=C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C26H32O4/c1-4-6-7-8-9-10-21-11-13-23(14-12-21)26(28)30-20(3)25(27)22-15-17-24(18-16-22)29-19-5-2/h5,11-18,20H,2,4,6-10,19H2,1,3H3