1-(1,3-benzodioxol-5-yl)-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]methanimine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]methanimine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]methanimine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[1-[2-(4-morpholin-4-iumyl)ethyl]-2-benzimidazolyl]methanimine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]methanimine Traditional Name: [1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]-piperonylidene-amine Formula: C21H23N4O3+ MolecularWeight: 379.43232

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C3=CC=CC=C3N=C2N=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCC[NH+]1CCN2C3=CC=CC=C3N=C2N=CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H22N4O3/c1-2-4-18-17(3-1)23-21(25(18)8-7-24-9-11-26-12-10-24)22-14-16-5-6-19-20(13-16)28-15-27-19/h1-6,13-14H,7-12,15H2/p+1