[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium chloride

Systemtic Name: [5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium chloride Openeye Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-(3-pyridylmethyl)ammonium chloride CAS Name: [5-(3-chloro-2-methylphenyl)-2-furanyl]methyl-(3-pyridinylmethyl)ammonium chloride IUPAC Name: [5-(3-chloro-2-methylphenyl)furan-2-yl]methyl-(pyridin-3-ylmethyl)azanium chloride Traditional Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-(3-pyridylmethyl)ammonium chloride Formula: C18H18Cl2N2O MolecularWeight: 349.25432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CC3=CN=CC=C3.[Cl-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CC3=CN=CC=C3.[Cl-]

InChI

InChI=1S/C18H17ClN2O.ClH/c1-13-16(5-2-6-17(13)19)18-8-7-15(22-18)12-21-11-14-4-3-9-20-10-14;/h2-10,21H,11-12H2,1H3;1H