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

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-[3-[methyl(phenyl)amino]propyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[3-(N-methylanilino)propyl]ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(N-methylanilino)propyl]ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-[3-(N-methylanilino)propyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[3-(N-methylanilino)propyl]ammonium Formula: C17H22ClN2O+ MolecularWeight: 305.82238

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC[NH2+]CC1=C(C=CC(=C1)Cl)O)C2=CC=CC=C2

Isomeric SMILES

CN(CCC[NH2+]CC1=C(C=CC(=C1)Cl)O)C2=CC=CC=C2

InChI

InChI=1S/C17H21ClN2O/c1-20(16-6-3-2-4-7-16)11-5-10-19-13-14-12-15(18)8-9-17(14)21/h2-4,6-9,12,19,21H,5,10-11,13H2,1H3/p+1