(E)-3-[6-methoxy-5-phenylmethoxy-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[6-methoxy-5-phenylmethoxy-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoic acid Openeye Name: (E)-3-[5-benzyloxy-3-(4-benzyloxyphenoxy)-6-methoxy-benzothiophen-2-yl]-2-(4-pyridyl)prop-2-enoic acid CAS Name: (E)-3-[6-methoxy-5-phenylmethoxy-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-2-propenoic acid IUPAC Name: (E)-3-[6-methoxy-5-phenylmethoxy-3-(4-phenylmethoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-ylprop-2-enoic acid Traditional Name: (E)-3-[5-benzoxy-3-(4-benzoxyphenoxy)-6-methoxy-benzothiophen-2-yl]-2-(4-pyridyl)acrylic acid Formula: C37H29NO6S MolecularWeight: 615.69426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)SC(=C2OC3=CC=C(C=C3)OCC4=CC=CC=C4)C=C(C5=CC=NC=C5)C(=O)O)OCC6=CC=CC=C6

Isomeric SMILES

COC1=C(C=C2C(=C1)SC(=C2OC3=CC=C(C=C3)OCC4=CC=CC=C4)/C=C(\C5=CC=NC=C5)/C(=O)O)OCC6=CC=CC=C6

InChI

InChI=1S/C37H29NO6S/c1-41-32-22-34-31(20-33(32)43-24-26-10-6-3-7-11-26)36(35(45-34)21-30(37(39)40)27-16-18-38-19-17-27)44-29-14-12-28(13-15-29)42-23-25-8-4-2-5-9-25/h2-22H,23-24H2,1H3,(H,39,40)/b30-21+