hex-5-enyl 2-heptan-2-ylbenzoate

Systemtic Name: hex-5-enyl 2-heptan-2-ylbenzoate Openeye Name: hex-5-enyl 2-(1-methylhexyl)benzoate CAS Name: 2-heptan-2-ylbenzoic acid hex-5-enyl ester IUPAC Name: hex-5-enyl 2-heptan-2-ylbenzoate Traditional Name: 2-(1-methylhexyl)benzoic acid hex-5-enyl ester Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1=CC=CC=C1C(=O)OCCCCC=C

Isomeric SMILES

CCCCCC(C)C1=CC=CC=C1C(=O)OCCCCC=C

InChI

InChI=1S/C20H30O2/c1-4-6-8-12-16-22-20(21)19-15-11-10-14-18(19)17(3)13-9-7-5-2/h4,10-11,14-15,17H,1,5-9,12-13,16H2,2-3H3