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

Systemtic Name: 8-chloranyl-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Openeye Name: 8-chloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate CAS Name: 8-chloro-4-[2-(4-morpholin-4-iumyl)ethylamino]-3-quinolinecarboxylate IUPAC Name: 8-chloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Traditional Name: 8-chloro-4-(2-morpholin-4-ium-4-ylethylamino)quinoline-3-carboxylate Formula: C16H18ClN3O3 MolecularWeight: 335.78542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3O3/c17-13-3-1-2-11-14(12(16(21)22)10-19-15(11)13)18-4-5-20-6-8-23-9-7-20/h1-3,10H,4-9H2,(H,18,19)(H,21,22)