2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-N-(1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-N-(1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-(2-amino-3-ethyl-1-benzimidazol-1-iumyl)-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(2-amino-3-ethylbenzimidazol-1-ium-1-yl)-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-N-(1,3-benzodioxol-5-yl)acetamide Formula: C18H19N4O3+ MolecularWeight: 339.36846

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18N4O3/c1-2-21-13-5-3-4-6-14(13)22(18(21)19)10-17(23)20-12-7-8-15-16(9-12)25-11-24-15/h3-9,19H,2,10-11H2,1H3,(H,20,23)/p+1