[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(pyridin-2-ylmethyl)azanium chloride

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(pyridin-2-ylmethyl)azanium chloride Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-(2-pyridylmethyl)ammonium chloride CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(2-pyridinylmethyl)ammonium chloride IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(pyridin-2-ylmethyl)azanium chloride Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-(2-pyridylmethyl)ammonium chloride Formula: C16H20ClN3O3 MolecularWeight: 337.8013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=N2)OCC(=O)N.[Cl-]

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=N2)OCC(=O)N.[Cl-]

InChI

InChI=1S/C16H19N3O3.ClH/c1-21-15-8-12(5-6-14(15)22-11-16(17)20)9-18-10-13-4-2-3-7-19-13;/h2-8,18H,9-11H2,1H3,(H2,17,20);1H