[3-(methoxymethyl)-1-benzothiophen-5-yl] benzenesulfonate

Systemtic Name: [3-(methoxymethyl)-1-benzothiophen-5-yl] benzenesulfonate Openeye Name: [3-(methoxymethyl)benzothiophen-5-yl] benzenesulfonate CAS Name: benzenesulfonic acid [3-(methoxymethyl)-1-benzothiophen-5-yl] ester IUPAC Name: [3-(methoxymethyl)-1-benzothiophen-5-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-(methoxymethyl)benzothiophen-5-yl] ester Formula: C16H14O4S2 MolecularWeight: 334.40996

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CSC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COCC1=CSC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14O4S2/c1-19-10-12-11-21-16-8-7-13(9-15(12)16)20-22(17,18)14-5-3-2-4-6-14/h2-9,11H,10H2,1H3