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

Systemtic Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] pentanoate Openeye Name: [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] pentanoate CAS Name: pentanoic acid [4-[4-(4-heptan-2-yl-1-cyclohexenyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-heptan-2-ylcyclohexen-1-yl)phenyl]phenyl] pentanoate Traditional Name: valeric acid [4-[4-[4-(1-methylhexyl)cyclohexen-1-yl]phenyl]phenyl] ester Formula: C30H40O2 MolecularWeight: 432.6374

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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)CCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H40O2/c1-4-6-8-9-23(3)24-11-13-25(14-12-24)26-15-17-27(18-16-26)28-19-21-29(22-20-28)32-30(31)10-7-5-2/h13,15-24H,4-12,14H2,1-3H3