ethyl 1-methyl-4-[4-(5-nitrofuran-2-yl)carbonylpiperazin-1-yl]-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-methyl-4-[4-(5-nitrofuran-2-yl)carbonylpiperazin-1-yl]-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-methyl-4-[4-(5-nitrofuran-2-carbonyl)piperazin-1-yl]-2-oxo-quinoline-3-carboxylate CAS Name: 1-methyl-4-[4-[(5-nitro-2-furanyl)-oxomethyl]-1-piperazinyl]-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[4-(5-nitrofuran-2-carbonyl)piperazin-1-yl]-2-oxoquinoline-3-carboxylate Traditional Name: 2-keto-1-methyl-4-[4-(5-nitro-2-furoyl)piperazino]quinoline-3-carboxylic acid ethyl ester Formula: C22H22N4O7 MolecularWeight: 454.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O7/c1-3-32-22(29)18-19(14-6-4-5-7-15(14)23(2)21(18)28)24-10-12-25(13-11-24)20(27)16-8-9-17(33-16)26(30)31/h4-9H,3,10-13H2,1-2H3