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

Systemtic Name: ethyl 4-(dimethylaminomethyl)-2-(4-methoxyphenyl)-5-oxidanyl-1-benzofuran-3-carboxylate hydrochloride Openeye Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)benzofuran-3-carboxylate hydrochloride CAS Name: 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)-3-benzofurancarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)-1-benzofuran-3-carboxylate hydrochloride Traditional Name: 4-(dimethylaminomethyl)-5-hydroxy-2-(4-methoxyphenyl)benzofuran-3-carboxylic acid ethyl ester hydrochloride Formula: C21H24ClNO5 MolecularWeight: 405.87196

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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.Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO5.ClH/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;1H