1-cyclopropyl-7-[4-(hydroxymethyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]-8-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(hydroxymethyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]-8-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-hydroxy-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethyl-1-piperidyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-hydroxy-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethyl-1-piperidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-hydroxy-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethylpiperidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-8-hydroxy-7-(4-hydroxy-3,5-dimethyl-4-methylol-piperidino)-4-keto-quinoline-3-carboxylic acid Formula: C21H26N2O6 MolecularWeight: 402.44094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1(CO)O)C)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)O

Isomeric SMILES

CC1CN(CC(C1(CO)O)C)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)O

InChI

InChI=1S/C21H26N2O6/c1-11-7-22(8-12(2)21(11,29)10-24)16-6-5-14-17(19(16)26)23(13-3-4-13)9-15(18(14)25)20(27)28/h5-6,9,11-13,24,26,29H,3-4,7-8,10H2,1-2H3,(H,27,28)