(5-chloranyl-2-oxidanyl-phenyl)methyl-hexyl-azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-hexyl-azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-hexyl-ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-hexylammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-hexylazanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-hexyl-ammonium Formula: C13H21ClNO+ MolecularWeight: 242.76494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1=C(C=CC(=C1)Cl)O

Isomeric SMILES

CCCCCC[NH2+]CC1=C(C=CC(=C1)Cl)O

InChI

InChI=1S/C13H20ClNO/c1-2-3-4-5-8-15-10-11-9-12(14)6-7-13(11)16/h6-7,9,15-16H,2-5,8,10H2,1H3/p+1