pentyl 4-butylbenzoate

Systemtic Name: pentyl 4-butylbenzoate Openeye Name: pentyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid pentyl ester IUPAC Name: pentyl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid amyl ester Formula: C16H24O2 MolecularWeight: 248.36056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O2/c1-3-5-7-13-18-16(17)15-11-9-14(10-12-15)8-6-4-2/h9-12H,3-8,13H2,1-2H3