N-(1,3-benzodioxol-5-yl)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-methoxy-3-piperidinosulfonyl-phenyl)acrylamide Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

InChI

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