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

Systemtic Name: 2-[2-[4-(4-heptoxyphenyl)phenyl]ethanoyl]-5-methyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(4-heptoxyphenyl)phenyl]acetyl]-5-methyl-cyclohexanone CAS Name: 2-[2-[4-(4-heptoxyphenyl)phenyl]-1-oxoethyl]-5-methyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(4-heptoxyphenyl)phenyl]acetyl]-5-methylcyclohexan-1-one Traditional Name: 2-[2-[4-(4-heptoxyphenyl)phenyl]acetyl]-5-methyl-cyclohexanone Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36O3/c1-3-4-5-6-7-18-31-25-15-13-24(14-16-25)23-11-9-22(10-12-23)20-28(30)26-17-8-21(2)19-27(26)29/h9-16,21,26H,3-8,17-20H2,1-2H3