methyl 6-(4-heptylphenyl)-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-(4-heptylphenyl)-6-oxidanylidene-hexanoate Openeye Name: methyl 6-(4-heptylphenyl)-6-oxo-hexanoate CAS Name: 6-(4-heptylphenyl)-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-(4-heptylphenyl)-6-oxohexanoate Traditional Name: 6-(4-heptylphenyl)-6-keto-hexanoic acid methyl ester Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)CCCCC(=O)OC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)CCCCC(=O)OC

InChI

InChI=1S/C20H30O3/c1-3-4-5-6-7-10-17-13-15-18(16-14-17)19(21)11-8-9-12-20(22)23-2/h13-16H,3-12H2,1-2H3