methyl 1,1-bis(oxidanylidene)-3-phenyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 1,1-bis(oxidanylidene)-3-phenyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 1,1-dioxo-3-phenyl-benzothiophene-2-carboxylate CAS Name: 1,1-dioxo-3-phenyl-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 1,1-dioxo-3-phenyl-1-benzothiophene-2-carboxylate Traditional Name: 1,1-diketo-3-phenyl-benzothiophene-2-carboxylic acid methyl ester Formula: C16H12O4S MolecularWeight: 300.32908

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1(=O)=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1(=O)=O)C3=CC=CC=C3

InChI

InChI=1S/C16H12O4S/c1-20-16(17)15-14(11-7-3-2-4-8-11)12-9-5-6-10-13(12)21(15,18)19/h2-10H,1H3