2-[[4-[2-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[2-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[2-[2,4-dimethoxy-5-(2-thienyl)phenyl]prop-2-enoyl]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[2-(2,4-dimethoxy-5-thiophen-2-ylphenyl)-1-oxoprop-2-enyl]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[2-(2,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[2-[2,4-dimethoxy-5-(2-thienyl)phenyl]acryloyl]phenyl]sulfonylamino]acetic acid Formula: C23H21NO7S2 MolecularWeight: 487.54534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=CS2)C(=C)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=CS2)C(=C)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC(=O)O)OC

InChI

InChI=1S/C23H21NO7S2/c1-14(17-11-18(21-5-4-10-32-21)20(31-3)12-19(17)30-2)23(27)15-6-8-16(9-7-15)33(28,29)24-13-22(25)26/h4-12,24H,1,13H2,2-3H3,(H,25,26)