2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-(2-cyanoethyl)-1-[3-(diethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C23H29N6+ MolecularWeight: 389.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CCC#N

Isomeric SMILES

CCN(CC)CCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CCC#N

InChI

InChI=1S/C23H28N6/c1-4-28(5-2)15-9-14-26-22-18(10-8-13-24)17(3)19(16-25)23-27-20-11-6-7-12-21(20)29(22)23/h6-7,11-12H,4-5,8-10,14-15H2,1-3H3,(H,26,27)/p+1