2-[4-(furan-2-ylmethylsulfanyl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(furan-2-ylmethylsulfanyl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(2-furylmethylsulfanyl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(2-furanylmethylthio)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(furan-2-ylmethylsulfanyl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(2-furfurylthio)butyl]isoindoline-1,3-quinone Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSCC3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSCC3=CC=CO3

InChI

InChI=1S/C17H17NO3S/c19-16-14-7-1-2-8-15(14)17(20)18(16)9-3-4-11-22-12-13-6-5-10-21-13/h1-2,5-8,10H,3-4,9,11-12H2