7,8-bis(chloranyl)-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate

Systemtic Name: 7,8-bis(chloranyl)-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Openeye Name: 7,8-dichloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate CAS Name: 7,8-dichloro-4-[2-(4-morpholin-4-iumyl)ethylamino]-3-quinolinecarboxylate IUPAC Name: 7,8-dichloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Traditional Name: 7,8-dichloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Formula: C16H17Cl2N3O3 MolecularWeight: 370.23048

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=C3C=CC(=C(C3=NC=C2C(=O)[O-])Cl)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC2=C3C=CC(=C(C3=NC=C2C(=O)[O-])Cl)Cl

InChI

InChI=1S/C16H17Cl2N3O3/c17-12-2-1-10-14(19-3-4-21-5-7-24-8-6-21)11(16(22)23)9-20-15(10)13(12)18/h1-2,9H,3-8H2,(H,19,20)(H,22,23)