2-[(6-azanylpyridin-1-ium-3-yl)amino]-4-ethylsulfonyl-phenol

Systemtic Name: 2-[(6-azanylpyridin-1-ium-3-yl)amino]-4-ethylsulfonyl-phenol Openeye Name: 2-[(6-aminopyridin-1-ium-3-yl)amino]-4-ethylsulfonyl-phenol CAS Name: 2-[(6-amino-3-pyridin-1-iumyl)amino]-4-ethylsulfonylphenol IUPAC Name: 2-[(6-aminopyridin-1-ium-3-yl)amino]-4-ethylsulfonylphenol Traditional Name: 2-[(6-aminopyridin-1-ium-3-yl)amino]-4-esyl-phenol Formula: C13H16N3O3S+ MolecularWeight: 294.34944

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C[NH+]=C(C=C2)N

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=C[NH+]=C(C=C2)N

InChI

InChI=1S/C13H15N3O3S/c1-2-20(18,19)10-4-5-12(17)11(7-10)16-9-3-6-13(14)15-8-9/h3-8,16-17H,2H2,1H3,(H2,14,15)/p+1