(E)-3-(1,3-benzodioxol-5-yl)-N-(3-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-morpholinosulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(3-morpholinosulfonylphenyl)acrylamide Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O6S/c23-20(7-5-15-4-6-18-19(12-15)28-14-27-18)21-16-2-1-3-17(13-16)29(24,25)22-8-10-26-11-9-22/h1-7,12-13H,8-11,14H2,(H,21,23)/b7-5+