N-(4-bromanyl-2-methyl-phenyl)-1-ethyl-piperidin-1-ium-4-amine

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-ethyl-piperidin-1-ium-4-amine Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-ethyl-piperidin-1-ium-4-amine CAS Name: N-(4-bromo-2-methylphenyl)-1-ethyl-4-piperidin-1-iumamine IUPAC Name: N-(4-bromo-2-methylphenyl)-1-ethylpiperidin-1-ium-4-amine Traditional Name: (4-bromo-2-methyl-phenyl)-(1-ethylpiperidin-1-ium-4-yl)amine Formula: C14H22BrN2+ MolecularWeight: 298.24188

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C14H21BrN2/c1-3-17-8-6-13(7-9-17)16-14-5-4-12(15)10-11(14)2/h4-5,10,13,16H,3,6-9H2,1-2H3/p+1