ethyl 5-[2-(4-cyanophenoxy)ethanoyloxy]-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[2-(4-cyanophenoxy)ethanoyloxy]-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[2-(4-cyanophenoxy)acetyl]oxy-4-(dimethylaminomethyl)-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[2-(4-cyanophenoxy)-1-oxoethoxy]-4-(dimethylaminomethyl)-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-cyanophenoxy)acetyl]oxy-4-(dimethylaminomethyl)-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[2-(4-cyanophenoxy)acetyl]oxy-4-(dimethylaminomethyl)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C29H26N2O6 MolecularWeight: 498.52654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC(=O)COC3=CC=C(C=C3)C#N)CN(C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2)OC(=O)COC3=CC=C(C=C3)C#N)CN(C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H26N2O6/c1-4-34-29(33)27-26-22(17-31(2)3)23(14-15-24(26)37-28(27)20-8-6-5-7-9-20)36-25(32)18-35-21-12-10-19(16-30)11-13-21/h5-15H,4,17-18H2,1-3H3