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

Systemtic Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] propanoate Openeye Name: [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] propanoate CAS Name: propanoic acid [4-[4-(4-heptan-2-yl-1-cyclohexenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] propanoate Traditional Name: propionic acid [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] ester Formula: C28H36O2 MolecularWeight: 404.58424

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C28H36O2/c1-4-6-7-8-21(3)22-9-11-23(12-10-22)24-13-15-25(16-14-24)26-17-19-27(20-18-26)30-28(29)5-2/h11,13-22H,4-10,12H2,1-3H3