7-methyl-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile

Systemtic Name: 7-methyl-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile Openeye Name: 7-methyl-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile CAS Name: 7-methyl-2-(1-piperazin-4-iumyl)-3-quinolinecarbonitrile IUPAC Name: 7-methyl-2-piperazin-4-ium-1-ylquinoline-3-carbonitrile Traditional Name: 7-methyl-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile Formula: C15H17N4+ MolecularWeight: 253.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)N3CC[NH2+]CC3)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)N3CC[NH2+]CC3)C#N

InChI

InChI=1S/C15H16N4/c1-11-2-3-12-9-13(10-16)15(18-14(12)8-11)19-6-4-17-5-7-19/h2-3,8-9,17H,4-7H2,1H3/p+1