(2-methoxyquinolin-4-yl)-[(3R,4R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-piperidin-1-yl]methanone

Systemtic Name: (2-methoxyquinolin-4-yl)-[(3R,4R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-piperidin-1-yl]methanone Openeye Name: [(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)-1-piperidyl]-(2-methoxy-4-quinolyl)methanone CAS Name: [(3R,4R)-3-hydroxy-4-(4-methyl-1-piperazinyl)-1-piperidinyl]-(2-methoxy-4-quinolinyl)methanone IUPAC Name: [(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)piperidin-1-yl]-(2-methoxyquinolin-4-yl)methanone Traditional Name: [(3R,4R)-3-hydroxy-4-(4-methylpiperazino)piperidino]-(2-methoxy-4-quinolyl)methanone Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2O)C(=O)C3=CC(=NC4=CC=CC=C43)OC

Isomeric SMILES

CN1CCN(CC1)[C@@H]2CCN(C[C@H]2O)C(=O)C3=CC(=NC4=CC=CC=C43)OC

InChI

InChI=1S/C21H28N4O3/c1-23-9-11-24(12-10-23)18-7-8-25(14-19(18)26)21(27)16-13-20(28-2)22-17-6-4-3-5-15(16)17/h3-6,13,18-19,26H,7-12,14H2,1-2H3/t18-,19-/m1/s1