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

Systemtic Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] ethanoate Openeye Name: [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] acetate CAS Name: acetic acid [4-[4-(4-heptan-2-yl-1-cyclohexenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] acetate Traditional Name: acetic acid [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] ester Formula: C27H34O2 MolecularWeight: 390.55766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C27H34O2/c1-4-5-6-7-20(2)22-8-10-23(11-9-22)24-12-14-25(15-13-24)26-16-18-27(19-17-26)29-21(3)28/h10,12-20,22H,4-9,11H2,1-3H3