sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoate

Systemtic Name: sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoate Openeye Name: sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)benzothiophen-2-yl]-2-(4-pyridyl)prop-2-enoate CAS Name: sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-yl-2-propenoate IUPAC Name: sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)-1-benzothiophen-2-yl]-2-pyridin-4-ylprop-2-enoate Traditional Name: sodium (Z)-3-[5,6-dimethoxy-3-(4-methoxyphenoxy)benzothiophen-2-yl]-2-(4-pyridyl)acrylate Formula: C25H20NNaO6S MolecularWeight: 485.48417

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(SC3=CC(=C(C=C32)OC)OC)C=C(C4=CC=NC=C4)C(=O)[O-].[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(SC3=CC(=C(C=C32)OC)OC)/C=C(/C4=CC=NC=C4)\C(=O)[O-].[Na+]

InChI

InChI=1S/C25H21NO6S.Na/c1-29-16-4-6-17(7-5-16)32-24-19-12-20(30-2)21(31-3)14-22(19)33-23(24)13-18(25(27)28)15-8-10-26-11-9-15;/h4-14H,1-3H3,(H,27,28);/q;+1/p-1/b18-13-;