4-methyl-2-(3-methylnon-1-en-3-yl)benzoate

Systemtic Name: 4-methyl-2-(3-methylnon-1-en-3-yl)benzoate Openeye Name: 4-methyl-2-(1-methyl-1-vinyl-heptyl)benzoate CAS Name: 4-methyl-2-(3-methylnon-1-en-3-yl)benzoate IUPAC Name: 4-methyl-2-(3-methylnon-1-en-3-yl)benzoate Traditional Name: 2-(1-hexyl-1-methyl-allyl)-4-methyl-benzoate Formula: C18H25O2- MolecularWeight: 273.3899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C=C)C1=C(C=CC(=C1)C)C(=O)[O-]

Isomeric SMILES

CCCCCCC(C)(C=C)C1=C(C=CC(=C1)C)C(=O)[O-]

InChI

InChI=1S/C18H26O2/c1-5-7-8-9-12-18(4,6-2)16-13-14(3)10-11-15(16)17(19)20/h6,10-11,13H,2,5,7-9,12H2,1,3-4H3,(H,19,20)/p-1