2-[5,8-bis(chloranyl)-4-(dimethylamino)quinolin-1-ium-2-yl]ethanoate

Systemtic Name: 2-[5,8-bis(chloranyl)-4-(dimethylamino)quinolin-1-ium-2-yl]ethanoate Openeye Name: 2-[5,8-dichloro-4-(dimethylamino)quinolin-1-ium-2-yl]acetate CAS Name: 2-[5,8-dichloro-4-(dimethylamino)-2-quinolin-1-iumyl]acetate IUPAC Name: 2-[5,8-dichloro-4-(dimethylamino)quinolin-1-ium-2-yl]acetate Traditional Name: 2-[5,8-dichloro-4-(dimethylamino)quinolin-1-ium-2-yl]acetate Formula: C13H12Cl2N2O2 MolecularWeight: 299.15258

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=[NH+]C2=C(C=CC(=C12)Cl)Cl)CC(=O)[O-]

Isomeric SMILES

CN(C)C1=CC(=[NH+]C2=C(C=CC(=C12)Cl)Cl)CC(=O)[O-]

InChI

InChI=1S/C13H12Cl2N2O2/c1-17(2)10-5-7(6-11(18)19)16-13-9(15)4-3-8(14)12(10)13/h3-5H,6H2,1-2H3,(H,18,19)