(3,3-dimethyl-2-oxidanylidene-butyl) 2,4,5-trimethoxybenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2,4,5-trimethoxybenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H22O6 MolecularWeight: 310.34228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC(=C(C=C1OC)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC(=C(C=C1OC)OC)OC

InChI

InChI=1S/C16H22O6/c1-16(2,3)14(17)9-22-15(18)10-7-12(20-5)13(21-6)8-11(10)19-4/h7-8H,9H2,1-6H3