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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C=CC3=CC4=C(C=C3)OCO4

InChI

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