(5-chloranyl-2-oxidanyl-phenyl)methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-(3-isopropoxypropyl)ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-(3-isopropoxypropyl)ammonium Formula: C13H21ClNO2+ MolecularWeight: 258.76434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClNO2/c1-10(2)17-7-3-6-15-9-11-8-12(14)4-5-13(11)16/h4-5,8,10,15-16H,3,6-7,9H2,1-2H3/p+1