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5-heptyl-2-[2-[4-(4-octoxyphenyl)cyclohexyl]ethanoyl]cyclohexan-1-one
5-heptyl-2-[2-[4-(4-octoxyphenyl)cyclohexyl]ethanoyl]cyclohexan-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCCOC1=CC=C(C=C1)C2CCC(CC2)CC(=O)C3CCC(CC3=O)CCCCCCC
Isomeric SMILES
CCCCCCCCOC1=CC=C(C=C1)C2CCC(CC2)CC(=O)C3CCC(CC3=O)CCCCCCC
InChI
InChI=1S/C35H56O3/c1-3-5-7-9-11-13-25-38-32-22-20-31(21-23-32)30-18-15-29(16-19-30)27-35(37)33-24-17-28(26-34(33)36)14-12-10-8-6-4-2/h20-23,28-30,33H,3-19,24-27H2,1-2H3
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