N-(4-bromanyl-3-methyl-phenyl)-1-methyl-piperidin-1-ium-4-amine

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-methyl-piperidin-1-ium-4-amine Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-methyl-piperidin-1-ium-4-amine CAS Name: N-(4-bromo-3-methylphenyl)-1-methyl-4-piperidin-1-iumamine IUPAC Name: N-(4-bromo-3-methylphenyl)-1-methylpiperidin-1-ium-4-amine Traditional Name: (4-bromo-3-methyl-phenyl)-(1-methylpiperidin-1-ium-4-yl)amine Formula: C13H20BrN2+ MolecularWeight: 284.2153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2CC[NH+](CC2)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2CC[NH+](CC2)C)Br

InChI

InChI=1S/C13H19BrN2/c1-10-9-12(3-4-13(10)14)15-11-5-7-16(2)8-6-11/h3-4,9,11,15H,5-8H2,1-2H3/p+1