2-(1-chloranyloctylsulfanyl)isoindole-1,3-dione

Systemtic Name: 2-(1-chloranyloctylsulfanyl)isoindole-1,3-dione Openeye Name: 2-(1-chlorooctylsulfanyl)isoindoline-1,3-dione CAS Name: 2-(1-chlorooctylthio)isoindole-1,3-dione IUPAC Name: 2-(1-chlorooctylsulfanyl)isoindole-1,3-dione Traditional Name: 2-(1-chlorooctylthio)isoindoline-1,3-quinone Formula: C16H20ClNO2S MolecularWeight: 325.8535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(SN1C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CCCCCCCC(SN1C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C16H20ClNO2S/c1-2-3-4-5-6-11-14(17)21-18-15(19)12-9-7-8-10-13(12)16(18)20/h7-10,14H,2-6,11H2,1H3