7-[4-[1,2-bis(oxidanyl)ethyl]-3,5-dimethyl-piperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[1,2-bis(oxidanyl)ethyl]-3,5-dimethyl-piperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(1,2-dihydroxyethyl)-3,5-dimethyl-1-piperidyl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-(1,2-dihydroxyethyl)-3,5-dimethyl-1-piperidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(1,2-dihydroxyethyl)-3,5-dimethylpiperidin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(1,2-dihydroxyethyl)-3,5-dimethyl-piperidino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H30N2O6 MolecularWeight: 430.4941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1C(CO)O)C)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC

Isomeric SMILES

CC1CN(CC(C1C(CO)O)C)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC

InChI

InChI=1S/C23H30N2O6/c1-12-8-24(9-13(2)19(12)18(27)11-26)17-7-6-15-20(22(17)31-3)25(14-4-5-14)10-16(21(15)28)23(29)30/h6-7,10,12-14,18-19,26-27H,4-5,8-9,11H2,1-3H3,(H,29,30)