1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-methyl-2-propan-2-yl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-methyl-2-propan-2-yl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-isopropyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-methyl-2-propan-2-yl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-methyl-2-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-isopropyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C33H34N5+ MolecularWeight: 500.65656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1C(C)C)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1C(C)C)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C#N

InChI

InChI=1S/C33H33N5/c1-23(2)30-24(3)27(22-34)32-35-28-16-10-11-17-29(28)38(32)33(30)37-20-18-36(19-21-37)31(25-12-6-4-7-13-25)26-14-8-5-9-15-26/h4-17,23,31H,18-21H2,1-3H3/p+1