(E)-3-(1,3-benzodioxol-5-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-piperidinosulfonylbenzyl)acrylamide Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24N2O5S/c25-22(11-7-17-6-10-20-21(14-17)29-16-28-20)23-15-18-4-8-19(9-5-18)30(26,27)24-12-2-1-3-13-24/h4-11,14H,1-3,12-13,15-16H2,(H,23,25)/b11-7+