methyl 6-[4-[[4-(6-methoxy-6-oxidanylidene-hexyl)phenyl]methyl]phenyl]hexanoate

Systemtic Name: methyl 6-[4-[[4-(6-methoxy-6-oxidanylidene-hexyl)phenyl]methyl]phenyl]hexanoate Openeye Name: methyl 6-[4-[[4-(6-methoxy-6-oxo-hexyl)phenyl]methyl]phenyl]hexanoate CAS Name: 6-[4-[[4-(6-methoxy-6-oxohexyl)phenyl]methyl]phenyl]hexanoic acid methyl ester IUPAC Name: methyl 6-[4-[[4-(6-methoxy-6-oxohexyl)phenyl]methyl]phenyl]hexanoate Traditional Name: 6-[4-[4-(6-keto-6-methoxy-hexyl)benzyl]phenyl]hexanoic acid methyl ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCC1=CC=C(C=C1)CC2=CC=C(C=C2)CCCCCC(=O)OC

Isomeric SMILES

COC(=O)CCCCCC1=CC=C(C=C1)CC2=CC=C(C=C2)CCCCCC(=O)OC

InChI

InChI=1S/C27H36O4/c1-30-26(28)11-7-3-5-9-22-13-17-24(18-14-22)21-25-19-15-23(16-20-25)10-6-4-8-12-27(29)31-2/h13-20H,3-12,21H2,1-2H3