8-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde

Systemtic Name: 8-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Openeye Name: 8-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde CAS Name: 8-methyl-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolinecarboxaldehyde IUPAC Name: 8-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Traditional Name: 8-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)N3CC[NH+](CC3)C)C=O

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)N3CC[NH+](CC3)C)C=O

InChI

InChI=1S/C16H19N3O/c1-12-4-3-5-13-10-14(11-20)16(17-15(12)13)19-8-6-18(2)7-9-19/h3-5,10-11H,6-9H2,1-2H3/p+1