(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-phenyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-phenyl-1-pyrrolidino-ethanone Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=CC=CC=C2)SC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H](C2=CC=CC=C2)SC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H21NO3S/c22-20(21-10-4-5-11-21)19(15-6-2-1-3-7-15)25-16-8-9-17-18(14-16)24-13-12-23-17/h1-3,6-9,14,19H,4-5,10-13H2/t19-/m1/s1