(2R)-1-[2-azanyl-3-[3-(dimethylamino)propyl]benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-ol

Systemtic Name: (2R)-1-[2-azanyl-3-[3-(dimethylamino)propyl]benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-ol Openeye Name: (2R)-1-[2-amino-3-[3-(dimethylamino)propyl]benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-ol CAS Name: (2R)-1-[2-amino-3-[3-(dimethylamino)propyl]-1-benzimidazol-1-iumyl]-3,3-dimethyl-2-butanol IUPAC Name: (2R)-1-[2-amino-3-[3-(dimethylamino)propyl]benzimidazol-1-ium-1-yl]-3,3-dimethylbutan-2-ol Traditional Name: (2R)-1-[2-amino-3-[3-(dimethylamino)propyl]benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-ol Formula: C18H31N4O+ MolecularWeight: 319.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C[N+]1=C(N(C2=CC=CC=C21)CCCN(C)C)N)O

Isomeric SMILES

CC(C)(C)[C@H](C[N+]1=C(N(C2=CC=CC=C21)CCCN(C)C)N)O

InChI

InChI=1S/C18H30N4O/c1-18(2,3)16(23)13-22-15-10-7-6-9-14(15)21(17(22)19)12-8-11-20(4)5/h6-7,9-10,16,19,23H,8,11-13H2,1-5H3/p+1/t16-/m0/s1