N-[(3R)-1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-3-yl]quinoline-8-sulfonamide

Systemtic Name: N-[(3R)-1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-3-yl]quinoline-8-sulfonamide Openeye Name: N-[(3R)-1-[[3-(2-hydroxyethoxy)phenyl]methyl]-3-piperidyl]quinoline-8-sulfonamide CAS Name: N-[(3R)-1-[[3-(2-hydroxyethoxy)phenyl]methyl]-3-piperidinyl]-8-quinolinesulfonamide IUPAC Name: N-[(3R)-1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-3-yl]quinoline-8-sulfonamide Traditional Name: N-[(3R)-1-[3-(2-hydroxyethoxy)benzyl]-3-piperidyl]quinoline-8-sulfonamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC(=CC=C2)OCCO)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1C[C@H](CN(C1)CC2=CC(=CC=C2)OCCO)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H27N3O4S/c27-13-14-30-21-9-1-5-18(15-21)16-26-12-4-8-20(17-26)25-31(28,29)22-10-2-6-19-7-3-11-24-23(19)22/h1-3,5-7,9-11,15,20,25,27H,4,8,12-14,16-17H2/t20-/m1/s1