[(1S)-1-(4-bromophenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(4-bromophenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(4-bromophenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(4-bromophenyl)ethyl]-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(4-bromophenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-(4-bromophenyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C16H27BrN2+2 MolecularWeight: 327.30298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)Br)[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C16H25BrN2/c1-14(15-6-8-16(17)9-7-15)18-10-5-13-19-11-3-2-4-12-19/h6-9,14,18H,2-5,10-13H2,1H3/p+2/t14-/m0/s1