decyl 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)ethanoate

Systemtic Name: decyl 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)ethanoate Openeye Name: decyl 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)acetate CAS Name: 2-(2,3-dimethyl-1-benzimidazol-3-iumyl)acetic acid decyl ester IUPAC Name: decyl 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)acetate Traditional Name: 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)acetic acid decyl ester Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CN1C(=[N+](C2=CC=CC=C21)C)C

Isomeric SMILES

CCCCCCCCCCOC(=O)CN1C(=[N+](C2=CC=CC=C21)C)C

InChI

InChI=1S/C21H33N2O2/c1-4-5-6-7-8-9-10-13-16-25-21(24)17-23-18(2)22(3)19-14-11-12-15-20(19)23/h11-12,14-15H,4-10,13,16-17H2,1-3H3/q+1