(3,3-dimethyl-2-oxidanylidene-butyl) 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C18H22O5 MolecularWeight: 318.36428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C18H22O5/c1-5-21-10-13-12-8-6-7-9-14(12)23-16(13)17(20)22-11-15(19)18(2,3)4/h6-9H,5,10-11H2,1-4H3