1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-ethyl-1-(homoveratrylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C25H27N4O2+ MolecularWeight: 415.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H26N4O2/c1-5-18-16(2)19(15-26)25-28-20-8-6-7-9-21(20)29(25)24(18)27-13-12-17-10-11-22(30-3)23(14-17)31-4/h6-11,14H,5,12-13H2,1-4H3,(H,27,28)/p+1