[4-(1,3-dithiolan-2-yl)phenyl] 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinecarboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidine-3-carboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C22H21NO5S2 MolecularWeight: 443.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)OC4=CC=C(C=C4)C5SCCS5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)OC4=CC=C(C=C4)C5SCCS5

InChI

InChI=1S/C22H21NO5S2/c24-20-11-15(13-23(20)16-3-6-18-19(12-16)27-8-7-26-18)21(25)28-17-4-1-14(2-5-17)22-29-9-10-30-22/h1-6,12,15,22H,7-11,13H2