[(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropyl-morpholin-3-yl]methyl 4-piperidin-1-ylpiperidine-1-carboxylate

Systemtic Name: [(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropyl-morpholin-3-yl]methyl 4-piperidin-1-ylpiperidine-1-carboxylate Openeye Name: [(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropyl-morpholin-3-yl]methyl 4-(1-piperidyl)piperidine-1-carboxylate CAS Name: 4-(1-piperidinyl)-1-piperidinecarboxylic acid [(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropyl-3-morpholinyl]methyl ester IUPAC Name: [(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropylmorpholin-3-yl]methyl 4-piperidin-1-ylpiperidine-1-carboxylate Traditional Name: 4-piperidinopiperidine-1-carboxylic acid [(3R,5R)-4-(4-chlorophenyl)sulfonyl-5-cyclopropyl-morpholin-3-yl]methyl ester Formula: C25H36ClN3O5S MolecularWeight: 526.08844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)OCC3COCC(N3S(=O)(=O)C4=CC=C(C=C4)Cl)C5CC5

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)OC[C@H]3COC[C@H](N3S(=O)(=O)C4=CC=C(C=C4)Cl)C5CC5

InChI

InChI=1S/C25H36ClN3O5S/c26-20-6-8-23(9-7-20)35(31,32)29-22(16-33-18-24(29)19-4-5-19)17-34-25(30)28-14-10-21(11-15-28)27-12-2-1-3-13-27/h6-9,19,21-22,24H,1-5,10-18H2/t22-,24+/m1/s1