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

Systemtic Name: 1-cyclopropyl-7-[4-(hydroxymethyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethyl-1-piperidyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethyl-1-piperidinyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-hydroxy-4-(hydroxymethyl)-3,5-dimethylpiperidin-1-yl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(4-hydroxy-3,5-dimethyl-4-methylol-piperidino)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5/c1-12-8-23(9-13(2)22(12,29)11-25)18-7-6-16-19(14(18)3)24(15-4-5-15)10-17(20(16)26)21(27)28/h6-7,10,12-13,15,25,29H,4-5,8-9,11H2,1-3H3,(H,27,28)