(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-methylsulfanylbenzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-methylsulfanylbenzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C17H15ClO4S MolecularWeight: 350.8166

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C17H15ClO4S/c1-23-15-4-2-11(3-5-15)17(19)21-9-13-7-14(18)6-12-8-20-10-22-16(12)13/h2-7H,8-10H2,1H3