hexyl 4-butylbenzoate

Systemtic Name: hexyl 4-butylbenzoate Openeye Name: hexyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid hexyl ester IUPAC Name: hexyl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid hexyl ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)CCCC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)CCCC

InChI

InChI=1S/C17H26O2/c1-3-5-7-8-14-19-17(18)16-12-10-15(11-13-16)9-6-4-2/h10-13H,3-9,14H2,1-2H3