[(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium IUPAC Name: [(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(3-bromophenyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium Formula: C14H24BrN3+2 MolecularWeight: 314.26446

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(C[NH3+])C2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CCCN(CC1)[C@@H](C[NH3+])C2=CC(=CC=C2)Br

InChI

InChI=1S/C14H22BrN3/c1-17-6-3-7-18(9-8-17)14(11-16)12-4-2-5-13(15)10-12/h2,4-5,10,14H,3,6-9,11,16H2,1H3/p+2/t14-/m0/s1