(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl (2R)-2-phenylsulfanylpropanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl (2R)-2-phenylsulfanylpropanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H17ClO4S MolecularWeight: 364.84318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=C2C(=CC(=C1)Cl)COCO2)SC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC1=C2C(=CC(=C1)Cl)COCO2)SC3=CC=CC=C3

InChI

InChI=1S/C18H17ClO4S/c1-12(24-16-5-3-2-4-6-16)18(20)22-10-14-8-15(19)7-13-9-21-11-23-17(13)14/h2-8,12H,9-11H2,1H3/t12-/m1/s1