(E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)acrylamide Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H24N2O6S/c1-2-28-19-9-7-17(14-21(19)31(26,27)24-11-3-4-12-24)23-22(25)10-6-16-5-8-18-20(13-16)30-15-29-18/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,23,25)/b10-6+