7-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 7-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Openeye Name: 7-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid CAS Name: 7-methyl-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolinecarboxylic acid IUPAC Name: 7-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Traditional Name: 7-methyl-2-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(=O)O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(=O)O)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H19N3O2/c1-11-3-4-12-10-13(16(20)21)15(17-14(12)9-11)19-7-5-18(2)6-8-19/h3-4,9-10H,5-8H2,1-2H3,(H,20,21)/p+1