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

Systemtic Name: (E)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)-2-(4-propan-2-ylphenyl)prop-2-enoic acid Openeye Name: (E)-3-(5,6-dimethoxybenzothiophen-2-yl)-2-(4-isopropylphenyl)prop-2-enoic acid CAS Name: (E)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)-2-(4-propan-2-ylphenyl)-2-propenoic acid IUPAC Name: (E)-3-(5,6-dimethoxy-1-benzothiophen-2-yl)-2-(4-propan-2-ylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(5,6-dimethoxybenzothiophen-2-yl)-2-p-cumenyl-acrylic acid Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=CC2=CC3=CC(=C(C=C3S2)OC)OC)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C(=C\C2=CC3=CC(=C(C=C3S2)OC)OC)/C(=O)O

InChI

InChI=1S/C22H22O4S/c1-13(2)14-5-7-15(8-6-14)18(22(23)24)11-17-9-16-10-19(25-3)20(26-4)12-21(16)27-17/h5-13H,1-4H3,(H,23,24)/b18-11+