[5,6-bis(phenylmethoxy)-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate

Systemtic Name: [5,6-bis(phenylmethoxy)-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate Openeye Name: [5,6-dibenzyloxy-3-(4-benzyloxyphenoxy)benzothiophen-2-yl] 2-(4-pyridyl)prop-2-enoate CAS Name: 2-pyridin-4-yl-2-propenoic acid [5,6-bis(phenylmethoxy)-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl] ester IUPAC Name: [5,6-bis(phenylmethoxy)-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl] 2-pyridin-4-ylprop-2-enoate Traditional Name: 2-(4-pyridyl)acrylic acid [5,6-dibenzoxy-3-(4-benzoxyphenoxy)benzothiophen-2-yl] ester Formula: C43H33NO6S MolecularWeight: 691.79022

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC=NC=C1)C(=O)OC2=C(C3=CC(=C(C=C3S2)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC6=CC=C(C=C6)OCC7=CC=CC=C7

Isomeric SMILES

C=C(C1=CC=NC=C1)C(=O)OC2=C(C3=CC(=C(C=C3S2)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC6=CC=C(C=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C43H33NO6S/c1-30(34-21-23-44-24-22-34)42(45)50-43-41(49-36-19-17-35(18-20-36)46-27-31-11-5-2-6-12-31)37-25-38(47-28-32-13-7-3-8-14-32)39(26-40(37)51-43)48-29-33-15-9-4-10-16-33/h2-26H,1,27-29H2