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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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