1-tert-butyl-8-methyl-6-nitro-4-oxidanylidene-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-tert-butyl-8-methyl-6-nitro-4-oxidanylidene-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid Openeye Name: 1-tert-butyl-8-methyl-6-nitro-4-oxo-7-[4-(1-piperidyl)-1-piperidyl]quinoline-3-carboxylic acid CAS Name: 1-tert-butyl-8-methyl-6-nitro-4-oxo-7-[4-(1-piperidinyl)-1-piperidinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-tert-butyl-8-methyl-6-nitro-4-oxo-7-(4-piperidin-1-ylpiperidin-1-yl)quinoline-3-carboxylic acid Traditional Name: 1-tert-butyl-4-keto-8-methyl-6-nitro-7-(4-piperidinopiperidino)quinoline-3-carboxylic acid Formula: C25H34N4O5 MolecularWeight: 470.56126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC(CC3)N4CCCCC4)[N+](=O)[O-])C(=O)C(=CN2C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC(CC3)N4CCCCC4)[N+](=O)[O-])C(=O)C(=CN2C(C)(C)C)C(=O)O

InChI

InChI=1S/C25H34N4O5/c1-16-21-18(23(30)19(24(31)32)15-28(21)25(2,3)4)14-20(29(33)34)22(16)27-12-8-17(9-13-27)26-10-6-5-7-11-26/h14-15,17H,5-13H2,1-4H3,(H,31,32)