(E)-2-(4-cyanophenyl)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-2-(4-cyanophenyl)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)prop-2-enoic acid Openeye Name: (E)-2-(4-cyanophenyl)-3-(5,6-dimethoxybenzothiophen-2-yl)prop-2-enoic acid CAS Name: (E)-2-(4-cyanophenyl)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)-2-propenoic acid IUPAC Name: (E)-2-(4-cyanophenyl)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)prop-2-enoic acid Traditional Name: (E)-2-(4-cyanophenyl)-3-(5,6-dimethoxybenzothiophen-2-yl)acrylic acid Formula: C20H15NO4S MolecularWeight: 365.4024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(S2)C=C(C3=CC=C(C=C3)C#N)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(S2)/C=C(\C3=CC=C(C=C3)C#N)/C(=O)O)OC

InChI

InChI=1S/C20H15NO4S/c1-24-17-8-14-7-15(26-19(14)10-18(17)25-2)9-16(20(22)23)13-5-3-12(11-21)4-6-13/h3-10H,1-2H3,(H,22,23)/b16-9+