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

Systemtic Name: (8-chloranylquinolin-2-yl)-[(3R,4R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-piperidin-1-yl]methanone Openeye Name: (8-chloro-2-quinolyl)-[(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)-1-piperidyl]methanone CAS Name: (8-chloro-2-quinolinyl)-[(3R,4R)-3-hydroxy-4-(4-methyl-1-piperazinyl)-1-piperidinyl]methanone IUPAC Name: (8-chloroquinolin-2-yl)-[(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)piperidin-1-yl]methanone Traditional Name: (8-chloro-2-quinolyl)-[(3R,4R)-3-hydroxy-4-(4-methylpiperazino)piperidino]methanone Formula: C20H25ClN4O2 MolecularWeight: 388.8911

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2O)C(=O)C3=NC4=C(C=CC=C4Cl)C=C3

Isomeric SMILES

CN1CCN(CC1)[C@@H]2CCN(C[C@H]2O)C(=O)C3=NC4=C(C=CC=C4Cl)C=C3

InChI

InChI=1S/C20H25ClN4O2/c1-23-9-11-24(12-10-23)17-7-8-25(13-18(17)26)20(27)16-6-5-14-3-2-4-15(21)19(14)22-16/h2-6,17-18,26H,7-13H2,1H3/t17-,18-/m1/s1