[1-(dodecoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium-2-yl]-phenyl-methanol chloride

Systemtic Name: [1-(dodecoxymethyl)-3-(phenylmethyl)benzimidazol-3-ium-2-yl]-phenyl-methanol chloride Openeye Name: [1-benzyl-3-(dodecoxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol chloride CAS Name: [1-(dodecoxymethyl)-3-(phenylmethyl)-2-benzimidazol-3-iumyl]-phenylmethanol chloride IUPAC Name: [1-benzyl-3-(dodecoxymethyl)benzimidazol-1-ium-2-yl]-phenylmethanol chloride Traditional Name: [1-benzyl-3-(lauryloxymethyl)benzimidazol-1-ium-2-yl]-phenyl-methanol chloride Formula: C34H45ClN2O2 MolecularWeight: 549.1863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)CC4=CC=CC=C4.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1C(C3=CC=CC=C3)O)CC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C34H45N2O2.ClH/c1-2-3-4-5-6-7-8-9-10-19-26-38-28-36-32-25-18-17-24-31(32)35(27-29-20-13-11-14-21-29)34(36)33(37)30-22-15-12-16-23-30;/h11-18,20-25,33,37H,2-10,19,26-28H2,1H3;1H/q+1;/p-1