2-[2-(4-ethoxyphenyl)ethanoyl]-5-pentyl-cyclohexan-1-one

Systemtic Name: 2-[2-(4-ethoxyphenyl)ethanoyl]-5-pentyl-cyclohexan-1-one Openeye Name: 2-[2-(4-ethoxyphenyl)acetyl]-5-pentyl-cyclohexanone CAS Name: 2-[2-(4-ethoxyphenyl)-1-oxoethyl]-5-pentyl-1-cyclohexanone IUPAC Name: 2-[2-(4-ethoxyphenyl)acetyl]-5-pentylcyclohexan-1-one Traditional Name: 5-amyl-2-(2-p-phenetylacetyl)cyclohexanone Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(C(=O)C1)C(=O)CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCC1CCC(C(=O)C1)C(=O)CC2=CC=C(C=C2)OCC

InChI

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