7-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile

Systemtic Name: 7-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Openeye Name: 7-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile CAS Name: 7-methoxy-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolinecarbonitrile IUPAC Name: 7-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Traditional Name: 7-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonitrile Formula: C16H19N4O+ MolecularWeight: 283.34826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O/c1-19-5-7-20(8-6-19)16-13(11-17)9-12-3-4-14(21-2)10-15(12)18-16/h3-4,9-10H,5-8H2,1-2H3/p+1