(5-chloranyl-2-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-(3-pyridylmethyl)ammonium Formula: C13H14ClN2O+ MolecularWeight: 249.71606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C[NH2+]CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C1=CC(=CN=C1)C[NH2+]CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C13H13ClN2O/c14-12-3-4-13(17)11(6-12)9-16-8-10-2-1-5-15-7-10/h1-7,16-17H,8-9H2/p+1