ethyl 6-(morpholin-4-ylmethyl)-8-nitro-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(morpholin-4-ylmethyl)-8-nitro-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-(morpholinomethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(4-morpholinylmethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(morpholin-4-ylmethyl)-8-nitro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 4-keto-6-(morpholinomethyl)-8-nitro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)CN3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)CN3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6/c1-2-26-17(22)13-9-18-15-12(16(13)21)7-11(8-14(15)20(23)24)10-19-3-5-25-6-4-19/h7-9H,2-6,10H2,1H3,(H,18,21)