[5-chloranyl-2-(thiophen-2-ylmethoxy)phenyl]methyl-(pyridin-3-ylmethyl)azanium chloride

Systemtic Name: [5-chloranyl-2-(thiophen-2-ylmethoxy)phenyl]methyl-(pyridin-3-ylmethyl)azanium chloride Openeye Name: [5-chloro-2-(2-thienylmethoxy)phenyl]methyl-(3-pyridylmethyl)ammonium chloride CAS Name: [5-chloro-2-(thiophen-2-ylmethoxy)phenyl]methyl-(3-pyridinylmethyl)ammonium chloride IUPAC Name: [5-chloro-2-(thiophen-2-ylmethoxy)phenyl]methyl-(pyridin-3-ylmethyl)azanium chloride Traditional Name: [5-chloro-2-(2-thenyloxy)benzyl]-(3-pyridylmethyl)ammonium chloride Formula: C18H18Cl2N2OS MolecularWeight: 381.31932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C[NH2+]CC2=C(C=CC(=C2)Cl)OCC3=CC=CS3.[Cl-]

Isomeric SMILES

C1=CC(=CN=C1)C[NH2+]CC2=C(C=CC(=C2)Cl)OCC3=CC=CS3.[Cl-]

InChI

InChI=1S/C18H17ClN2OS.ClH/c19-16-5-6-18(22-13-17-4-2-8-23-17)15(9-16)12-21-11-14-3-1-7-20-10-14;/h1-10,21H,11-13H2;1H