ethyl 1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-7-(4-oxidanylpiperidin-1-yl)quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-7-(4-oxidanylpiperidin-1-yl)quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-7-(4-hydroxy-1-piperidyl)-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-7-(4-hydroxy-1-piperidinyl)-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-7-(4-hydroxypiperidin-1-yl)-8-methyl-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-7-(4-hydroxypiperidino)-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)[N+](=O)[O-])N3CCC(CC3)O)C)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)[N+](=O)[O-])N3CCC(CC3)O)C)C4CC4

InChI

InChI=1S/C21H25N3O6/c1-3-30-21(27)16-11-23(13-4-5-13)18-12(2)19(22-8-6-14(25)7-9-22)17(24(28)29)10-15(18)20(16)26/h10-11,13-14,25H,3-9H2,1-2H3