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

Systemtic Name: ethyl 4-(dimethylaminomethyl)-5-oxidanyl-2-phenyl-1-benzofuran-3-carboxylate hydrochloride Openeye Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-phenyl-benzofuran-3-carboxylate hydrochloride CAS Name: 4-(dimethylaminomethyl)-5-hydroxy-2-phenyl-3-benzofurancarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate hydrochloride Traditional Name: 4-(dimethylaminomethyl)-5-hydroxy-2-phenyl-benzofuran-3-carboxylic acid ethyl ester hydrochloride Formula: C20H22ClNO4 MolecularWeight: 375.84598

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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=CC=C3.Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO4.ClH/c1-4-24-20(23)18-17-14(12-21(2)3)15(22)10-11-16(17)25-19(18)13-8-6-5-7-9-13;/h5-11,22H,4,12H2,1-3H3;1H