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

Systemtic Name: 8-ethyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Openeye Name: 8-ethyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde CAS Name: 8-ethyl-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolinecarboxaldehyde IUPAC Name: 8-ethyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Traditional Name: 8-ethyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbaldehyde Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=CC(=C(N=C21)N3CC[NH+](CC3)C)C=O

Isomeric SMILES

CCC1=CC=CC2=CC(=C(N=C21)N3CC[NH+](CC3)C)C=O

InChI

InChI=1S/C17H21N3O/c1-3-13-5-4-6-14-11-15(12-21)17(18-16(13)14)20-9-7-19(2)8-10-20/h4-6,11-12H,3,7-10H2,1-2H3/p+1