3-methylbut-2-enyl 4-butylbenzoate

Systemtic Name: 3-methylbut-2-enyl 4-butylbenzoate Openeye Name: 3-methylbut-2-enyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid 3-methylbut-2-enyl ester Formula: C16H22O2 MolecularWeight: 246.34468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OCC=C(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OCC=C(C)C

InChI

InChI=1S/C16H22O2/c1-4-5-6-14-7-9-15(10-8-14)16(17)18-12-11-13(2)3/h7-11H,4-6,12H2,1-3H3