methyl 3-(3-chloranyl-1-benzothiophen-2-yl)-3-oxidanyl-propanoate

Systemtic Name: methyl 3-(3-chloranyl-1-benzothiophen-2-yl)-3-oxidanyl-propanoate Openeye Name: methyl 3-(3-chlorobenzothiophen-2-yl)-3-hydroxy-propanoate CAS Name: 3-(3-chloro-1-benzothiophen-2-yl)-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 3-(3-chloro-1-benzothiophen-2-yl)-3-hydroxypropanoate Traditional Name: 3-(3-chlorobenzothiophen-2-yl)-3-hydroxy-propionic acid methyl ester Formula: C12H11ClO3S MolecularWeight: 270.73194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=C(C2=CC=CC=C2S1)Cl)O

Isomeric SMILES

COC(=O)CC(C1=C(C2=CC=CC=C2S1)Cl)O

InChI

InChI=1S/C12H11ClO3S/c1-16-10(15)6-8(14)12-11(13)7-4-2-3-5-9(7)17-12/h2-5,8,14H,6H2,1H3