(3R,4R)-1-(phenylmethyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]pyrrolidin-3-ol

Systemtic Name: (3R,4R)-1-(phenylmethyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]pyrrolidin-3-ol Openeye Name: (3R,4R)-4-[4-(benzenesulfonyl)piperazin-1-yl]-1-benzyl-pyrrolidin-3-ol CAS Name: (3R,4R)-4-[4-(benzenesulfonyl)-1-piperazinyl]-1-(phenylmethyl)-3-pyrrolidinol IUPAC Name: (3R,4R)-4-[4-(benzenesulfonyl)piperazin-1-yl]-1-benzylpyrrolidin-3-ol Traditional Name: (3R,4R)-1-benzyl-4-(4-besylpiperazino)pyrrolidin-3-ol Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CN(CC2O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1[C@@H]2CN(C[C@H]2O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H27N3O3S/c25-21-17-22(15-18-7-3-1-4-8-18)16-20(21)23-11-13-24(14-12-23)28(26,27)19-9-5-2-6-10-19/h1-10,20-21,25H,11-17H2/t20-,21-/m1/s1