2-[3-(2,3,4-trimethoxyphenoxy)-1-benzothiophen-2-yl]benzenecarbonitrile

Systemtic Name: 2-[3-(2,3,4-trimethoxyphenoxy)-1-benzothiophen-2-yl]benzenecarbonitrile Openeye Name: 2-[3-(2,3,4-trimethoxyphenoxy)benzothiophen-2-yl]benzonitrile CAS Name: 2-[3-(2,3,4-trimethoxyphenoxy)-1-benzothiophen-2-yl]benzonitrile IUPAC Name: 2-[3-(2,3,4-trimethoxyphenoxy)-1-benzothiophen-2-yl]benzonitrile Traditional Name: 2-[3-(2,3,4-trimethoxyphenoxy)benzothiophen-2-yl]benzonitrile Formula: C24H19NO4S MolecularWeight: 417.47696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)OC2=C(SC3=CC=CC=C32)C4=CC=CC=C4C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)OC2=C(SC3=CC=CC=C32)C4=CC=CC=C4C#N)OC)OC

InChI

InChI=1S/C24H19NO4S/c1-26-18-12-13-19(23(28-3)22(18)27-2)29-21-17-10-6-7-11-20(17)30-24(21)16-9-5-4-8-15(16)14-25/h4-13H,1-3H3