7-chloranyl-1-ethyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 7-chloranyl-1-ethyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 7-chloro-1-ethyl-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 7-chloro-1-ethyl-6-nitro-4-oxo-3-quinolinecarboxylate IUPAC Name: 7-chloro-1-ethyl-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 7-chloro-1-ethyl-4-keto-6-nitro-quinoline-3-carboxylate Formula: C12H8ClN2O5- MolecularWeight: 295.65532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)Cl)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)Cl)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H9ClN2O5/c1-2-14-5-7(12(17)18)11(16)6-3-10(15(19)20)8(13)4-9(6)14/h3-5H,2H2,1H3,(H,17,18)/p-1