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

Systemtic Name: 2-[2-(4-hexoxyphenyl)ethanoyl]-5-methyl-cyclohexan-1-one Openeye Name: 2-[2-(4-hexoxyphenyl)acetyl]-5-methyl-cyclohexanone CAS Name: 2-[2-(4-hexoxyphenyl)-1-oxoethyl]-5-methyl-1-cyclohexanone IUPAC Name: 2-[2-(4-hexoxyphenyl)acetyl]-5-methylcyclohexan-1-one Traditional Name: 2-[2-(4-hexoxyphenyl)acetyl]-5-methyl-cyclohexanone Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)CC(=O)C2CCC(CC2=O)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)CC(=O)C2CCC(CC2=O)C

InChI

InChI=1S/C21H30O3/c1-3-4-5-6-13-24-18-10-8-17(9-11-18)15-21(23)19-12-7-16(2)14-20(19)22/h8-11,16,19H,3-7,12-15H2,1-2H3