ethyl 1-methyl-6-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 1-methyl-6-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate Openeye Name: ethyl 1-methyl-6-nitro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylate CAS Name: 1-methyl-6-nitro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-6-nitro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylate Traditional Name: 4-keto-1-methyl-6-nitro-7-piperazino-quinoline-3-carboxylic acid ethyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCNCC3)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)[N+](=O)[O-])N3CCNCC3)C

InChI

InChI=1S/C17H20N4O5/c1-3-26-17(23)12-10-19(2)13-9-14(20-6-4-18-5-7-20)15(21(24)25)8-11(13)16(12)22/h8-10,18H,3-7H2,1-2H3