[(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenyl-butyl]azanium

Systemtic Name: [(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenyl-butyl]azanium Openeye Name: [(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenyl-butyl]ammonium CAS Name: [(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenylbutyl]ammonium IUPAC Name: [(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenylbutyl]azanium Traditional Name: [(1R,2R)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-1-phenyl-butyl]ammonium Formula: C14H21N3+2 MolecularWeight: 231.33664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)[NH3+])[N+]2=C(NC=C2)C

Isomeric SMILES

CC[C@H]([C@@H](C1=CC=CC=C1)[NH3+])[N+]2=C(NC=C2)C

InChI

InChI=1S/C14H19N3/c1-3-13(17-10-9-16-11(17)2)14(15)12-7-5-4-6-8-12/h4-10,13-14H,3,15H2,1-2H3/p+2/t13-,14-/m1/s1