(5-chloranyl-2-oxidanyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C14H23ClN2O+2 MolecularWeight: 270.79822

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C14H21ClN2O/c1-16-7-5-13(6-8-16)17(2)10-11-9-12(15)3-4-14(11)18/h3-4,9,13,18H,5-8,10H2,1-2H3/p+2