2-[[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]methyl]indolizine-1-carbonitrile

Systemtic Name: 2-[[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Openeye Name: 2-[[4-(4-acetylphenyl)piperazin-1-ium-1-yl]methyl]indolizine-1-carbonitrile CAS Name: 2-[[4-(4-acetylphenyl)-1-piperazin-1-iumyl]methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[[4-(4-acetylphenyl)piperazin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Traditional Name: 2-[[4-(4-acetylphenyl)piperazin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Formula: C22H23N4O+ MolecularWeight: 359.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C22H22N4O/c1-17(27)18-5-7-20(8-6-18)25-12-10-24(11-13-25)15-19-16-26-9-3-2-4-22(26)21(19)14-23/h2-9,16H,10-13,15H2,1H3/p+1