(5-chloranyl-2-oxidanyl-phenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[3-(2-methoxyethoxy)propyl]ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(2-methoxyethoxy)propyl]ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[3-(2-methoxyethoxy)propyl]ammonium Formula: C13H21ClNO3+ MolecularWeight: 274.76374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClNO3/c1-17-7-8-18-6-2-5-15-10-11-9-12(14)3-4-13(11)16/h3-4,9,15-16H,2,5-8,10H2,1H3/p+1