3-methyl-1-(3-morpholin-4-ium-4-ylpropylamino)-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 3-methyl-1-(3-morpholin-4-ium-4-ylpropylamino)-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 3-methyl-1-(3-morpholin-4-ium-4-ylpropylamino)-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 3-methyl-1-[3-(4-morpholin-4-iumyl)propylamino]-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 3-methyl-1-(3-morpholin-4-ium-4-ylpropylamino)-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 3-methyl-1-(3-morpholin-4-ium-4-ylpropylamino)-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C23H31N5O+2 MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC[NH+]4CCOCC4

Isomeric SMILES

CCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C23H29N5O/c1-3-7-18-17(2)19(16-24)23-26-20-8-4-5-9-21(20)28(23)22(18)25-10-6-11-27-12-14-29-15-13-27/h4-5,8-9H,3,6-7,10-15H2,1-2H3,(H,25,26)/p+2