1-(dodecoxymethyl)-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-imine

Systemtic Name: 1-(dodecoxymethyl)-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-imine Openeye Name: 1-(dodecoxymethyl)-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-imine CAS Name: 1-(dodecoxymethyl)-3-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolimine IUPAC Name: 1-(dodecoxymethyl)-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-imine Traditional Name: [1-(lauryloxymethyl)-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-ylidene]amine Formula: C27H47N4O+ MolecularWeight: 443.68828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCN1C2=CC=CC=C2N(C1=N)CC[NH+]3CCCCC3

Isomeric SMILES

CCCCCCCCCCCCOCN1C2=CC=CC=C2N(C1=N)CC[NH+]3CCCCC3

InChI

InChI=1S/C27H46N4O/c1-2-3-4-5-6-7-8-9-10-16-23-32-24-31-26-18-13-12-17-25(26)30(27(31)28)22-21-29-19-14-11-15-20-29/h12-13,17-18,28H,2-11,14-16,19-24H2,1H3/p+1