7,8-bis(chloranyl)-4-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 7,8-bis(chloranyl)-4-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Openeye Name: 7,8-dichloro-4-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid CAS Name: 7,8-dichloro-4-(4-methyl-1-piperazin-4-iumyl)-3-quinolinecarboxylic acid IUPAC Name: 7,8-dichloro-4-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Traditional Name: 7,8-dichloro-4-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxylic acid Formula: C15H16Cl2N3O2+ MolecularWeight: 341.21244

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C3C=CC(=C(C3=NC=C2C(=O)O)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C3C=CC(=C(C3=NC=C2C(=O)O)Cl)Cl

InChI

InChI=1S/C15H15Cl2N3O2/c1-19-4-6-20(7-5-19)14-9-2-3-11(16)12(17)13(9)18-8-10(14)15(21)22/h2-3,8H,4-7H2,1H3,(H,21,22)/p+1