methyl 1-[(2R)-1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(2R)-1-oxidanylidene-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[(1R)-2-[4-(benzenesulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[(2R)-1-[4-(benzenesulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2R)-1-[4-(benzenesulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]piperidine-4-carboxylate Traditional Name: 1-[(1R)-2-(4-besylpiperazino)-2-keto-1-methyl-ethyl]isonipecotic acid methyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N3CCC(CC3)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C20H29N3O5S/c1-16(21-10-8-17(9-11-21)20(25)28-2)19(24)22-12-14-23(15-13-22)29(26,27)18-6-4-3-5-7-18/h3-7,16-17H,8-15H2,1-2H3/t16-/m1/s1