(E)-3-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoic acid Openeye Name: (E)-3-[2-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[2-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoic acid Traditional Name: (E)-3-[2-(2-keto-2-pyrrolidino-ethoxy)phenyl]-2-(5-pyrrolidinosulfonyl-2-thienyl)acrylic acid Formula: C23H26N2O6S2 MolecularWeight: 490.59234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=CC=C2C=C(C3=CC=C(S3)S(=O)(=O)N4CCCC4)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=CC=C2/C=C(/C3=CC=C(S3)S(=O)(=O)N4CCCC4)\C(=O)O

InChI

InChI=1S/C23H26N2O6S2/c26-21(24-11-3-4-12-24)16-31-19-8-2-1-7-17(19)15-18(23(27)28)20-9-10-22(32-20)33(29,30)25-13-5-6-14-25/h1-2,7-10,15H,3-6,11-14,16H2,(H,27,28)/b18-15-