(E)-3-[4-methoxy-3-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-methoxy-3-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-methoxy-3-[[2-methoxy-5-(1-piperidylsulfonyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-methoxy-3-[[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-methoxy-3-[(2-methoxy-5-piperidin-1-ylsulfonylphenyl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-methoxy-3-[(2-methoxy-5-piperidinosulfonyl-phenyl)sulfamoyl]phenyl]acrylic acid Formula: C22H26N2O8S2 MolecularWeight: 510.58044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=C(C=CC(=C3)C=CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=C(C=CC(=C3)/C=C/C(=O)O)OC

InChI

InChI=1S/C22H26N2O8S2/c1-31-19-10-8-17(34(29,30)24-12-4-3-5-13-24)15-18(19)23-33(27,28)21-14-16(7-11-22(25)26)6-9-20(21)32-2/h6-11,14-15,23H,3-5,12-13H2,1-2H3,(H,25,26)/b11-7+