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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyclopentylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyclopentylsulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyclopentylsulfonylphenyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyclopentylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyclopentylsulfonylphenyl)acrylamide Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21NO5S/c23-21(12-6-15-5-11-19-20(13-15)27-14-26-19)22-16-7-9-18(10-8-16)28(24,25)17-3-1-2-4-17/h5-13,17H,1-4,14H2,(H,22,23)/b12-6+