1-(4-fluorophenyl)-6-nitro-4-oxidanylidene-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-(4-fluorophenyl)-6-nitro-4-oxidanylidene-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid Openeye Name: 1-(4-fluorophenyl)-6-nitro-4-oxo-7-[4-(1-piperidyl)-1-piperidyl]quinoline-3-carboxylic acid CAS Name: 1-(4-fluorophenyl)-6-nitro-4-oxo-7-[4-(1-piperidinyl)-1-piperidinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-(4-fluorophenyl)-6-nitro-4-oxo-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid Traditional Name: 1-(4-fluorophenyl)-4-keto-6-nitro-7-(4-piperidinopiperidino)quinoline-3-carboxylic acid Formula: C26H27FN4O5 MolecularWeight: 494.514783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=CC=C(C=C5)F)[N+](=O)[O-]

InChI

InChI=1S/C26H27FN4O5/c27-17-4-6-19(7-5-17)30-16-21(26(33)34)25(32)20-14-24(31(35)36)23(15-22(20)30)29-12-8-18(9-13-29)28-10-2-1-3-11-28/h4-7,14-16,18H,1-3,8-13H2,(H,33,34)