6-azanyl-2-(4-ethylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile

Systemtic Name: 6-azanyl-2-(4-ethylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Openeye Name: 6-amino-2-(4-ethylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile CAS Name: 6-amino-2-(4-ethyl-1-piperazin-4-iumyl)-3-quinolinecarbonitrile IUPAC Name: 6-amino-2-(4-ethylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Traditional Name: 6-amino-2-(4-ethylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Formula: C16H20N5+ MolecularWeight: 282.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC3=C(C=C(C=C3)N)C=C2C#N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC3=C(C=C(C=C3)N)C=C2C#N

InChI

InChI=1S/C16H19N5/c1-2-20-5-7-21(8-6-20)16-13(11-17)9-12-10-14(18)3-4-15(12)19-16/h3-4,9-10H,2,5-8,18H2,1H3/p+1