ethyl 3-[[4-(2-cyanophenyl)phenyl]methoxy]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[4-(2-cyanophenyl)phenyl]methoxy]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[4-(2-cyanophenyl)phenyl]methoxy]benzothiophene-2-carboxylate CAS Name: 3-[[4-(2-cyanophenyl)phenyl]methoxy]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-(2-cyanophenyl)phenyl]methoxy]-1-benzothiophene-2-carboxylate Traditional Name: 3-[4-(2-cyanophenyl)benzyl]oxybenzothiophene-2-carboxylic acid ethyl ester Formula: C25H19NO3S MolecularWeight: 413.48826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2S1)OCC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2S1)OCC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H19NO3S/c1-2-28-25(27)24-23(21-9-5-6-10-22(21)30-24)29-16-17-11-13-18(14-12-17)20-8-4-3-7-19(20)15-26/h3-14H,2,16H2,1H3