[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl] ethanoate

Systemtic Name: [4-(4-heptan-2-ylcyclohexen-1-yl)phenyl] ethanoate Openeye Name: [4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl] acetate CAS Name: acetic acid [4-(4-heptan-2-yl-1-cyclohexenyl)phenyl] ester IUPAC Name: [4-(4-heptan-2-ylcyclohexen-1-yl)phenyl] acetate Traditional Name: acetic acid [4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl] ester Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)OC(=O)C

Isomeric SMILES

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)OC(=O)C

InChI

InChI=1S/C21H30O2/c1-4-5-6-7-16(2)18-8-10-19(11-9-18)20-12-14-21(15-13-20)23-17(3)22/h10,12-16,18H,4-9,11H2,1-3H3