ethyl 4,6-bis(dimethylaminomethyl)-5-oxidanyl-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4,6-bis(dimethylaminomethyl)-5-oxidanyl-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 4,6-bis(dimethylaminomethyl)-5-hydroxy-2-phenyl-benzofuran-3-carboxylate CAS Name: 4,6-bis(dimethylaminomethyl)-5-hydroxy-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-bis(dimethylaminomethyl)-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 4,6-bis(dimethylaminomethyl)-5-hydroxy-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O4/c1-6-28-23(27)20-19-17(14-25(4)5)21(26)16(13-24(2)3)12-18(19)29-22(20)15-10-8-7-9-11-15/h7-12,26H,6,13-14H2,1-5H3