[(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methyl-piperidin-2-yl]methyl 4-pyridin-2-ylpiperazine-1-carboxylate

Systemtic Name: [(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methyl-piperidin-2-yl]methyl 4-pyridin-2-ylpiperazine-1-carboxylate Openeye Name: [(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methyl-2-piperidyl]methyl 4-(2-pyridyl)piperazine-1-carboxylate CAS Name: 4-(2-pyridinyl)-1-piperazinecarboxylic acid [(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methyl-2-piperidinyl]methyl ester IUPAC Name: [(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methylpiperidin-2-yl]methyl 4-pyridin-2-ylpiperazine-1-carboxylate Traditional Name: 4-(2-pyridyl)piperazine-1-carboxylic acid [(2R,6R)-1-(4-chlorophenyl)sulfonyl-6-methyl-2-piperidyl]methyl ester Formula: C23H29ClN4O4S MolecularWeight: 493.01876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)Cl)COC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)Cl)COC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H29ClN4O4S/c1-18-5-4-6-20(28(18)33(30,31)21-10-8-19(24)9-11-21)17-32-23(29)27-15-13-26(14-16-27)22-7-2-3-12-25-22/h2-3,7-12,18,20H,4-6,13-17H2,1H3/t18-,20-/m1/s1