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

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-(2-diethylaminoethyl)azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-(2-diethylaminoethyl)ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-(2-diethylaminoethyl)ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-(2-diethylaminoethyl)azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-(2-diethylaminoethyl)ammonium Formula: C13H22ClN2O+ MolecularWeight: 257.77958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21ClN2O/c1-3-16(4-2)8-7-15-10-11-9-12(14)5-6-13(11)17/h5-6,9,15,17H,3-4,7-8,10H2,1-2H3/p+1