3-(2-diethylaminoethylsulfanyl)-3H-2-benzofuran-1-one chloride

Systemtic Name: 3-(2-diethylaminoethylsulfanyl)-3H-2-benzofuran-1-one chloride Openeye Name: 3-(2-diethylaminoethylsulfanyl)-3H-isobenzofuran-1-one chloride CAS Name: 3-(2-diethylaminoethylthio)-3H-isobenzofuran-1-one chloride IUPAC Name: 3-(2-diethylaminoethylsulfanyl)-3H-2-benzofuran-1-one chloride Traditional Name: 3-(2-diethylaminoethylthio)phthalide chloride Formula: C14H19ClNO2S- MolecularWeight: 300.82416

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1C2=CC=CC=C2C(=O)O1.[Cl-]

Isomeric SMILES

CCN(CC)CCSC1C2=CC=CC=C2C(=O)O1.[Cl-]

InChI

InChI=1S/C14H19NO2S.ClH/c1-3-15(4-2)9-10-18-14-12-8-6-5-7-11(12)13(16)17-14;/h5-8,14H,3-4,9-10H2,1-2H3;1H/p-1