[2-(methoxymethyl)-3-phenacyl-cyclohexen-1-yl] ethanoate

Systemtic Name: [2-(methoxymethyl)-3-phenacyl-cyclohexen-1-yl] ethanoate Openeye Name: [2-(methoxymethyl)-3-phenacyl-cyclohexen-1-yl] acetate CAS Name: acetic acid [2-(methoxymethyl)-3-phenacyl-1-cyclohexenyl] ester IUPAC Name: [2-(methoxymethyl)-3-phenacylcyclohexen-1-yl] acetate Traditional Name: acetic acid [2-(methoxymethyl)-3-phenacyl-cyclohexen-1-yl] ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(CCC1)CC(=O)C2=CC=CC=C2)COC

Isomeric SMILES

CC(=O)OC1=C(C(CCC1)CC(=O)C2=CC=CC=C2)COC

InChI

InChI=1S/C18H22O4/c1-13(19)22-18-10-6-9-15(16(18)12-21-2)11-17(20)14-7-4-3-5-8-14/h3-5,7-8,15H,6,9-12H2,1-2H3