5-(3-imidazol-1-ylpropylamino)-7-methyl-benzimidazolo[1,2-a]quinolin-12-ium-6-carbonitrile

Systemtic Name: 5-(3-imidazol-1-ylpropylamino)-7-methyl-benzimidazolo[1,2-a]quinolin-12-ium-6-carbonitrile Openeye Name: 5-(3-imidazol-1-ylpropylamino)-7-methyl-benzimidazolo[1,2-a]quinolin-12-ium-6-carbonitrile CAS Name: 5-[3-(1-imidazolyl)propylamino]-7-methyl-6-benzimidazolo[1,2-a]quinolin-12-iumcarbonitrile IUPAC Name: 5-(3-imidazol-1-ylpropylamino)-7-methylbenzimidazolo[1,2-a]quinolin-12-ium-6-carbonitrile Traditional Name: 5-(3-imidazol-1-ylpropylamino)-7-methyl-benzimidazolo[1,2-a]quinolin-12-ium-6-carbonitrile Formula: C23H21N6+ MolecularWeight: 381.45304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+]3=C1C(=C(C4=CC=CC=C43)NCCCN5C=CN=C5)C#N

Isomeric SMILES

CN1C2=CC=CC=C2[N+]3=C1C(=C(C4=CC=CC=C43)NCCCN5C=CN=C5)C#N

InChI

InChI=1S/C23H20N6/c1-27-20-9-4-5-10-21(20)29-19-8-3-2-7-17(19)22(18(15-24)23(27)29)26-11-6-13-28-14-12-25-16-28/h2-5,7-10,12,14,16H,6,11,13H2,1H3/p+1