6-(2-azaniumylethylamino)-7-chloranyl-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 6-(2-azaniumylethylamino)-7-chloranyl-1-cyclopropyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 6-(2-azaniumylethylamino)-7-chloro-1-cyclopropyl-4-oxo-quinoline-3-carboxylate CAS Name: 6-(2-ammonioethylamino)-7-chloro-1-cyclopropyl-4-oxo-3-quinolinecarboxylate IUPAC Name: 6-(2-azaniumylethylamino)-7-chloro-1-cyclopropyl-4-oxoquinoline-3-carboxylate Traditional Name: 6-(2-ammonioethylamino)-7-chloro-1-cyclopropyl-4-keto-quinoline-3-carboxylate Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)Cl)NCC[NH3+])C(=O)[O-]

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)Cl)NCC[NH3+])C(=O)[O-]

InChI

InChI=1S/C15H16ClN3O3/c16-11-6-13-9(5-12(11)18-4-3-17)14(20)10(15(21)22)7-19(13)8-1-2-8/h5-8,18H,1-4,17H2,(H,21,22)