ethyl 2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-benzofuran-3-carboxylate CAS Name: 2-(2-cyano-2,2-diphenylethyl)-5-methoxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-cyano-2,2-diphenylethyl)-5-methoxy-1-benzofuran-3-carboxylate Traditional Name: 2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-benzofuran-3-carboxylic acid ethyl ester Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23NO4/c1-3-31-26(29)25-22-16-21(30-2)14-15-23(22)32-24(25)17-27(18-28,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-16H,3,17H2,1-2H3