2-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]ethyl]isoindoline-1,3-quinone Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSCCN3C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSCCN3C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C19H16ClNO4S/c20-14-7-12-9-24-11-25-17(12)13(8-14)10-26-6-5-21-18(22)15-3-1-2-4-16(15)19(21)23/h1-4,7-8H,5-6,9-11H2