(1S,5R)-N-(2-bromanyl-4-methyl-phenyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-amine

Systemtic Name: (1S,5R)-N-(2-bromanyl-4-methyl-phenyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-amine Openeye Name: (1S,5R)-N-(2-bromo-4-methyl-phenyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-amine CAS Name: (1S,5R)-N-(2-bromo-4-methylphenyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-amine IUPAC Name: (1S,5R)-N-(2-bromo-4-methylphenyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-amine Traditional Name: (2-bromo-4-methyl-phenyl)-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]amine Formula: C15H22BrN2+ MolecularWeight: 310.25258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2CC3CCC(C2)[NH+]3C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC2C[C@H]3CC[C@@H](C2)[NH+]3C)Br

InChI

InChI=1S/C15H21BrN2/c1-10-3-6-15(14(16)7-10)17-11-8-12-4-5-13(9-11)18(12)2/h3,6-7,11-13,17H,4-5,8-9H2,1-2H3/p+1/t11?,12-,13+