[3-(4-chloranylphenoxy)-5,6-bis[(4-phenylphenyl)methoxy]-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate

Systemtic Name: [3-(4-chloranylphenoxy)-5,6-bis[(4-phenylphenyl)methoxy]-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate Openeye Name: [3-(4-chlorophenoxy)-5,6-bis[(4-phenylphenyl)methoxy]benzothiophen-2-yl] 2-(4-pyridyl)prop-2-enoate CAS Name: 2-pyridin-4-yl-2-propenoic acid [3-(4-chlorophenoxy)-5,6-bis[(4-phenylphenyl)methoxy]-1-benzothiophen-2-yl] ester IUPAC Name: [3-(4-chlorophenoxy)-5,6-bis[(4-phenylphenyl)methoxy]-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate Traditional Name: 2-(4-pyridyl)acrylic acid [3-(4-chlorophenoxy)-5,6-bis[(4-phenylbenzyl)oxy]benzothiophen-2-yl] ester Formula: C48H34ClNO5S MolecularWeight: 772.30526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC=NC=C1)C(=O)OC2=C(C3=CC(=C(C=C3S2)OCC4=CC=C(C=C4)C5=CC=CC=C5)OCC6=CC=C(C=C6)C7=CC=CC=C7)OC8=CC=C(C=C8)Cl

Isomeric SMILES

C=C(C1=CC=NC=C1)C(=O)OC2=C(C3=CC(=C(C=C3S2)OCC4=CC=C(C=C4)C5=CC=CC=C5)OCC6=CC=C(C=C6)C7=CC=CC=C7)OC8=CC=C(C=C8)Cl

InChI

InChI=1S/C48H34ClNO5S/c1-32(35-24-26-50-27-25-35)47(51)55-48-46(54-41-22-20-40(49)21-23-41)42-28-43(52-30-33-12-16-38(17-13-33)36-8-4-2-5-9-36)44(29-45(42)56-48)53-31-34-14-18-39(19-15-34)37-10-6-3-7-11-37/h2-29H,1,30-31H2