(3-chloranyl-1-benzothiophen-2-yl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 3-methylsulfonylbenzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C17H13ClO4S2 MolecularWeight: 380.86572

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClO4S2/c1-24(20,21)12-6-4-5-11(9-12)17(19)22-10-15-16(18)13-7-2-3-8-14(13)23-15/h2-9H,10H2,1H3