[1-[(2R)-2-(6-aminocarbonyloxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-4-yl] methanesulfonate

Systemtic Name: [1-[(2R)-2-(6-aminocarbonyloxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-4-yl] methanesulfonate Openeye Name: [1-[(2R)-2-(6-carbamoyloxy-4-quinolyl)-2-hydroxy-ethyl]-4-piperidyl] methanesulfonate CAS Name: methanesulfonic acid [1-[(2R)-2-(6-carbamoyloxy-4-quinolinyl)-2-hydroxyethyl]-4-piperidinyl] ester IUPAC Name: [1-[(2R)-2-(6-carbamoyloxyquinolin-4-yl)-2-hydroxyethyl]piperidin-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[(2R)-2-(6-carbamoyloxy-4-quinolyl)-2-hydroxy-ethyl]-4-piperidyl] ester Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCN(CC1)CC(C2=C3C=C(C=CC3=NC=C2)OC(=O)N)O

Isomeric SMILES

CS(=O)(=O)OC1CCN(CC1)C[C@@H](C2=C3C=C(C=CC3=NC=C2)OC(=O)N)O

InChI

InChI=1S/C18H23N3O6S/c1-28(24,25)27-12-5-8-21(9-6-12)11-17(22)14-4-7-20-16-3-2-13(10-15(14)16)26-18(19)23/h2-4,7,10,12,17,22H,5-6,8-9,11H2,1H3,(H2,19,23)/t17-/m0/s1