methanol; 3,6,6-trimethyl-4-oxidanylidene-N-(1-phenylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: methanol; 3,6,6-trimethyl-4-oxidanylidene-N-(1-phenylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: methanol; 3,6,6-trimethyl-4-oxo-N-(1-phenylethyl)-5,7-dihydrobenzofuran-2-carboxamide CAS Name: methanol; 3,6,6-trimethyl-4-oxo-N-(1-phenylethyl)-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: methanol; 3,6,6-trimethyl-4-oxo-N-(1-phenylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-N-(1-phenylethyl)-5,7-dihydrobenzofuran-2-carboxamide; methanol Formula: C21H27NO4 MolecularWeight: 357.44338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NC(C)C3=CC=CC=C3.CO

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NC(C)C3=CC=CC=C3.CO

InChI

InChI=1S/C20H23NO3.CH4O/c1-12-17-15(22)10-20(3,4)11-16(17)24-18(12)19(23)21-13(2)14-8-6-5-7-9-14;1-2/h5-9,13H,10-11H2,1-4H3,(H,21,23);2H,1H3