ethyl 1-ethyl-6-[(3-nitrophenyl)carbonylamino]-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-6-[(3-nitrophenyl)carbonylamino]-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6-[(3-nitrobenzoyl)amino]-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6-[[(3-nitrophenyl)-oxomethyl]amino]-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6-[(3-nitrobenzoyl)amino]-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-4-keto-6-[(3-nitrobenzoyl)amino]quinoline-3-carboxylic acid ethyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C21H19N3O6/c1-3-23-12-17(21(27)30-4-2)19(25)16-11-14(8-9-18(16)23)22-20(26)13-6-5-7-15(10-13)24(28)29/h5-12H,3-4H2,1-2H3,(H,22,26)