[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 3-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 3-(4-tert-butylphenoxy)propanoate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 3-(4-tert-butylphenoxy)propanoate CAS Name: 3-(4-tert-butylphenoxy)propanoic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 3-(4-tert-butylphenoxy)propanoate Traditional Name: 3-(4-tert-butylphenoxy)propionic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C22H24O6 MolecularWeight: 384.42236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H24O6/c1-22(2,3)16-5-7-17(8-6-16)25-11-10-21(24)26-13-18(23)15-4-9-19-20(12-15)28-14-27-19/h4-9,12H,10-11,13-14H2,1-3H3