2-(2,3-dihydro-1-benzofuran-2-ylmethylsulfanyl)isoindole-1,3-dione

Systemtic Name: 2-(2,3-dihydro-1-benzofuran-2-ylmethylsulfanyl)isoindole-1,3-dione Openeye Name: 2-(2,3-dihydrobenzofuran-2-ylmethylsulfanyl)isoindoline-1,3-dione CAS Name: 2-(2,3-dihydrobenzofuran-2-ylmethylthio)isoindole-1,3-dione IUPAC Name: 2-(2,3-dihydro-1-benzofuran-2-ylmethylsulfanyl)isoindole-1,3-dione Traditional Name: 2-(coumaran-2-ylmethylthio)isoindoline-1,3-quinone Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C21)CSN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1C(OC2=CC=CC=C21)CSN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C17H13NO3S/c19-16-13-6-2-3-7-14(13)17(20)18(16)22-10-12-9-11-5-1-4-8-15(11)21-12/h1-8,12H,9-10H2