ethyl 4-(dimethylaminomethyl)-2-(4-methoxyphenyl)-5-oxidanyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4-(dimethylaminomethyl)-2-(4-methoxyphenyl)-5-oxidanyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)benzofuran-3-carboxylate CAS Name: 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)-1-benzofuran-3-carboxylate Traditional Name: 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)benzofuran-3-carboxylic acid ethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)CN(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)O)CN(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23NO5/c1-5-26-21(24)19-18-15(12-22(2)3)16(23)10-11-17(18)27-20(19)13-6-8-14(25-4)9-7-13/h6-11,23H,5,12H2,1-4H3