N-(4-azanyl-5-methoxy-2-oxidanyl-phenyl)-2-pyridin-1-ium-2-yl-ethanamide chloride

Systemtic Name: N-(4-azanyl-5-methoxy-2-oxidanyl-phenyl)-2-pyridin-1-ium-2-yl-ethanamide chloride Openeye Name: N-(4-amino-2-hydroxy-5-methoxy-phenyl)-2-pyridin-1-ium-2-yl-acetamide chloride CAS Name: N-(4-amino-2-hydroxy-5-methoxyphenyl)-2-(2-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-(4-amino-2-hydroxy-5-methoxyphenyl)-2-pyridin-1-ium-2-ylacetamide chloride Traditional Name: N-(4-amino-2-hydroxy-5-methoxy-phenyl)-2-pyridin-1-ium-2-yl-acetamide chloride Formula: C14H16ClN3O3 MolecularWeight: 309.74814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N)O)NC(=O)CC2=CC=CC=[NH+]2.[Cl-]

Isomeric SMILES

COC1=CC(=C(C=C1N)O)NC(=O)CC2=CC=CC=[NH+]2.[Cl-]

InChI

InChI=1S/C14H15N3O3.ClH/c1-20-13-8-11(12(18)7-10(13)15)17-14(19)6-9-4-2-3-5-16-9;/h2-5,7-8,18H,6,15H2,1H3,(H,17,19);1H