[1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol

Systemtic Name: [1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol Openeye Name: [1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol CAS Name: [1-methyl-3-(nonoxymethyl)-2-benzimidazol-1-iumyl]-phenylmethanol IUPAC Name: [1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-phenylmethanol Traditional Name: [1-methyl-3-(nonoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol Formula: C25H35N2O2+ MolecularWeight: 395.5576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)C

Isomeric SMILES

CCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)C

InChI

InChI=1S/C25H35N2O2/c1-3-4-5-6-7-8-14-19-29-20-27-23-18-13-12-17-22(23)26(2)25(27)24(28)21-15-10-9-11-16-21/h9-13,15-18,24,28H,3-8,14,19-20H2,1-2H3/q+1