4-methyl-3-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylethyl]aniline

Systemtic Name: 4-methyl-3-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonylethyl]aniline Openeye Name: 4-methyl-3-[2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl]aniline CAS Name: 4-methyl-3-[2-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]ethyl]aniline IUPAC Name: 4-methyl-3-[2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl]aniline Traditional Name: [4-methyl-3-[2-(1-oxidopyridin-1-ium-2-yl)sulfonylethyl]phenyl]amine Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)CCS(=O)(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N)CCS(=O)(=O)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C14H16N2O3S/c1-11-5-6-13(15)10-12(11)7-9-20(18,19)14-4-2-3-8-16(14)17/h2-6,8,10H,7,9,15H2,1H3