[(1S)-1-(3-bromophenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(3-bromophenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(1S)-1-(3-bromophenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1S)-1-(3-bromophenyl)ethyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1S)-1-(3-bromophenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(1S)-1-(3-bromophenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C14H19BrN3+ MolecularWeight: 309.22476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)[NH2+]CCCN2C=CN=C2

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)Br)[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C14H18BrN3/c1-12(13-4-2-5-14(15)10-13)17-6-3-8-18-9-7-16-11-18/h2,4-5,7,9-12,17H,3,6,8H2,1H3/p+1/t12-/m0/s1