2-[2-ethenyl-4-(4-methoxyphenyl)sulfonyl-1-oxidanidyl-pyridin-1-ium-3-yl]-6-methoxy-aniline

Systemtic Name: 2-[2-ethenyl-4-(4-methoxyphenyl)sulfonyl-1-oxidanidyl-pyridin-1-ium-3-yl]-6-methoxy-aniline Openeye Name: 2-methoxy-6-[4-(4-methoxyphenyl)sulfonyl-1-oxido-2-vinyl-pyridin-1-ium-3-yl]aniline CAS Name: 2-[2-ethenyl-4-(4-methoxyphenyl)sulfonyl-1-oxido-3-pyridin-1-iumyl]-6-methoxyaniline IUPAC Name: 2-[2-ethenyl-4-(4-methoxyphenyl)sulfonyl-1-oxidopyridin-1-ium-3-yl]-6-methoxyaniline Traditional Name: [2-methoxy-6-[4-(4-methoxyphenyl)sulfonyl-1-oxido-2-vinyl-pyridin-1-ium-3-yl]phenyl]amine Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O5S/c1-4-17-20(16-6-5-7-18(28-3)21(16)22)19(12-13-23(17)24)29(25,26)15-10-8-14(27-2)9-11-15/h4-13H,1,22H2,2-3H3