[(1R,2R)-2-(2-methylbenzimidazol-1-yl)-1-phenyl-butyl]azanium

Systemtic Name: [(1R,2R)-2-(2-methylbenzimidazol-1-yl)-1-phenyl-butyl]azanium Openeye Name: [(1R,2R)-2-(2-methylbenzimidazol-1-yl)-1-phenyl-butyl]ammonium CAS Name: [(1R,2R)-2-(2-methyl-1-benzimidazolyl)-1-phenylbutyl]ammonium IUPAC Name: [(1R,2R)-2-(2-methylbenzimidazol-1-yl)-1-phenylbutyl]azanium Traditional Name: [(1R,2R)-2-(2-methylbenzimidazol-1-yl)-1-phenyl-butyl]ammonium Formula: C18H22N3+ MolecularWeight: 280.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)[NH3+])N2C(=NC3=CC=CC=C32)C

Isomeric SMILES

CC[C@H]([C@@H](C1=CC=CC=C1)[NH3+])N2C(=NC3=CC=CC=C32)C

InChI

InChI=1S/C18H21N3/c1-3-16(18(19)14-9-5-4-6-10-14)21-13(2)20-15-11-7-8-12-17(15)21/h4-12,16,18H,3,19H2,1-2H3/p+1/t16-,18-/m1/s1