phenyl 4-(4-heptan-2-ylcyclohexen-1-yl)hexanoate

Systemtic Name: phenyl 4-(4-heptan-2-ylcyclohexen-1-yl)hexanoate Openeye Name: phenyl 4-[4-(1-methylhexyl)cyclohexen-1-yl]hexanoate CAS Name: 4-(4-heptan-2-yl-1-cyclohexenyl)hexanoic acid phenyl ester IUPAC Name: phenyl 4-(4-heptan-2-ylcyclohexen-1-yl)hexanoate Traditional Name: 4-[4-(1-methylhexyl)cyclohexen-1-yl]hexanoic acid phenyl ester Formula: C25H38O2 MolecularWeight: 370.56802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CCC(=CC1)C(CC)CCC(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)C1CCC(=CC1)C(CC)CCC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C25H38O2/c1-4-6-8-11-20(3)22-14-16-23(17-15-22)21(5-2)18-19-25(26)27-24-12-9-7-10-13-24/h7,9-10,12-13,16,20-22H,4-6,8,11,14-15,17-19H2,1-3H3