4-methoxy-N-[6-[(E)-2-pyridin-4-ylethenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[6-[(E)-2-pyridin-4-ylethenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[6-[(E)-2-(4-pyridyl)vinyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-methoxy-N-[6-[(E)-2-pyridin-4-ylethenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[6-[(E)-2-pyridin-4-ylethenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-[6-[(E)-2-(4-pyridyl)vinyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2C=CC4=CC=NC=C4)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2/C=C/C4=CC=NC=C4)OCO3

InChI

InChI=1S/C21H18N2O5S/c1-26-17-4-6-18(7-5-17)29(24,25)23-19-13-21-20(27-14-28-21)12-16(19)3-2-15-8-10-22-11-9-15/h2-13,23H,14H2,1H3/b3-2+