methyl 5-methyl-3-oxidanyl-1,1-bis(oxidanylidene)-3-(phenylmethyl)-2H-1-benzothiophene-6-carboxylate

Systemtic Name: methyl 5-methyl-3-oxidanyl-1,1-bis(oxidanylidene)-3-(phenylmethyl)-2H-1-benzothiophene-6-carboxylate Openeye Name: methyl 3-benzyl-3-hydroxy-5-methyl-1,1-dioxo-2H-benzothiophene-6-carboxylate CAS Name: 3-hydroxy-5-methyl-1,1-dioxo-3-(phenylmethyl)-2H-1-benzothiophene-6-carboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-3-hydroxy-5-methyl-1,1-dioxo-2H-1-benzothiophene-6-carboxylate Traditional Name: 3-benzyl-3-hydroxy-1,1-diketo-5-methyl-2H-benzothiophene-6-carboxylic acid methyl ester Formula: C18H18O5S MolecularWeight: 346.39752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)OC)S(=O)(=O)CC2(CC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)OC)S(=O)(=O)CC2(CC3=CC=CC=C3)O

InChI

InChI=1S/C18H18O5S/c1-12-8-15-16(9-14(12)17(19)23-2)24(21,22)11-18(15,20)10-13-6-4-3-5-7-13/h3-9,20H,10-11H2,1-2H3