ethyl 4-(dimethylaminomethyl)-2-[[methyl(phenyl)amino]methyl]-5-oxidanyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4-(dimethylaminomethyl)-2-[[methyl(phenyl)amino]methyl]-5-oxidanyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-[(N-methylanilino)methyl]benzofuran-3-carboxylate CAS Name: 4-(dimethylaminomethyl)-5-hydroxy-2-[(N-methylanilino)methyl]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-[(N-methylanilino)methyl]-1-benzofuran-3-carboxylate Traditional Name: 4-(dimethylaminomethyl)-5-hydroxy-2-[(N-methylanilino)methyl]benzofuran-3-carboxylic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-5-27-22(26)21-19(14-24(4)15-9-7-6-8-10-15)28-18-12-11-17(25)16(20(18)21)13-23(2)3/h6-12,25H,5,13-14H2,1-4H3