[4-(1,3-dithiolan-2-yl)phenyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C18H16O4S2 MolecularWeight: 360.44724

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H16O4S2/c19-17(16-11-20-14-3-1-2-4-15(14)22-16)21-13-7-5-12(6-8-13)18-23-9-10-24-18/h1-8,16,18H,9-11H2/t16-/m0/s1