N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]benzenesulfonamide

Systemtic Name: N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]benzenesulfonamide Openeye Name: N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]benzenesulfonamide CAS Name: N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxido-4-pyridin-1-iumyl)ethenyl]phenyl]benzenesulfonamide IUPAC Name: N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]benzenesulfonamide Traditional Name: N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]benzenesulfonamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CCO)C2=CC=CC=C2C=CC3=CC=[N+](C=C3)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CCO)C2=CC=CC=C2/C=C/C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C22H22N2O5S/c1-29-20-8-10-21(11-9-20)30(27,28)24(16-17-25)22-5-3-2-4-19(22)7-6-18-12-14-23(26)15-13-18/h2-15,25H,16-17H2,1H3/b7-6+