3-(4-methylcyclohex-3-en-1-yl)but-3-enyl 2-methylbutanoate

Systemtic Name: 3-(4-methylcyclohex-3-en-1-yl)but-3-enyl 2-methylbutanoate Openeye Name: 3-(4-methylcyclohex-3-en-1-yl)but-3-enyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid 3-(4-methyl-1-cyclohex-3-enyl)but-3-enyl ester IUPAC Name: 3-(4-methylcyclohex-3-en-1-yl)but-3-enyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid 3-(4-methylcyclohex-3-en-1-yl)but-3-enyl ester Formula: C16H26O2 MolecularWeight: 250.37644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCCC(=C)C1CCC(=CC1)C

Isomeric SMILES

CCC(C)C(=O)OCCC(=C)C1CCC(=CC1)C

InChI

InChI=1S/C16H26O2/c1-5-13(3)16(17)18-11-10-14(4)15-8-6-12(2)7-9-15/h6,13,15H,4-5,7-11H2,1-3H3