methyl N-[4-[(1-methylpyridin-1-ium-2-yl)carbonylamino]-3-oxidanyl-phenyl]carbamate chloride

Systemtic Name: methyl N-[4-[(1-methylpyridin-1-ium-2-yl)carbonylamino]-3-oxidanyl-phenyl]carbamate chloride Openeye Name: methyl N-[3-hydroxy-4-[(1-methylpyridin-1-ium-2-carbonyl)amino]phenyl]carbamate chloride CAS Name: N-[3-hydroxy-4-[[(1-methyl-2-pyridin-1-iumyl)-oxomethyl]amino]phenyl]carbamic acid methyl ester chloride IUPAC Name: methyl N-[3-hydroxy-4-[(1-methylpyridin-1-ium-2-carbonyl)amino]phenyl]carbamate chloride Traditional Name: N-[3-hydroxy-4-[(1-methylpyridin-1-ium-2-carbonyl)amino]phenyl]carbamic acid methyl ester chloride Formula: C15H16ClN3O4 MolecularWeight: 337.75824

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)NC(=O)OC)O.[Cl-]

Isomeric SMILES

C[N+]1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)NC(=O)OC)O.[Cl-]

InChI

InChI=1S/C15H15N3O4.ClH/c1-18-8-4-3-5-12(18)14(20)17-11-7-6-10(9-13(11)19)16-15(21)22-2;/h3-9H,1-2H3,(H2,16,19,20,21);1H