1-[3-(1,1-dimethyl-3-oxidanylidene-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-naphthalen-1-yloxy-propan-2-ol

Systemtic Name: 1-[3-(1,1-dimethyl-3-oxidanylidene-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-naphthalen-1-yloxy-propan-2-ol Openeye Name: 1-[3-(1,1-dimethyl-3-oxo-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-(1-naphthyloxy)propan-2-ol CAS Name: 1-[3-(1,1-dimethyl-3-oxo-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-(1-naphthalenyloxy)-2-propanol IUPAC Name: 1-[3-(1,1-dimethyl-3-oxo-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-naphthalen-1-yloxypropan-2-ol Traditional Name: 1-[3-(3-keto-1,1-dimethyl-2H-benzimidazole-1,3-diium-2-yl)propylamino]-3-(1-naphthoxy)propan-2-ol Formula: C25H31N3O3+2 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C([N+](=O)C2=CC=CC=C21)CCCNCC(COC3=CC=CC4=CC=CC=C43)O)C

Isomeric SMILES

C[N+]1(C([N+](=O)C2=CC=CC=C21)CCCNCC(COC3=CC=CC4=CC=CC=C43)O)C

InChI

InChI=1S/C25H31N3O3/c1-28(2)23-13-6-5-12-22(23)27(30)25(28)15-8-16-26-17-20(29)18-31-24-14-7-10-19-9-3-4-11-21(19)24/h3-7,9-14,20,25-26,29H,8,15-18H2,1-2H3/q+2