5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]cyclohexan-1-one

Systemtic Name: 5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]cyclohexan-1-one Openeye Name: 5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]cyclohexanone CAS Name: 5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]-1-cyclohexanone IUPAC Name: 5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]cyclohexan-1-one Traditional Name: 5-ethyl-2-[4-(4-heptoxyphenyl)phenyl]cyclohexanone Formula: C27H36O2 MolecularWeight: 392.57354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3=O)CC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3=O)CC

InChI

InChI=1S/C27H36O2/c1-3-5-6-7-8-19-29-25-16-14-23(15-17-25)22-10-12-24(13-11-22)26-18-9-21(4-2)20-27(26)28/h10-17,21,26H,3-9,18-20H2,1-2H3