methyl 4,7-diphenyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 4,7-diphenyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 4,7-diphenylbenzothiophene-2-carboxylate CAS Name: 4,7-diphenyl-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 4,7-diphenyl-1-benzothiophene-2-carboxylate Traditional Name: 4,7-diphenylbenzothiophene-2-carboxylic acid methyl ester Formula: C22H16O2S MolecularWeight: 344.42624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2S1)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=CC(=C2S1)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H16O2S/c1-24-22(23)20-14-19-17(15-8-4-2-5-9-15)12-13-18(21(19)25-20)16-10-6-3-7-11-16/h2-14H,1H3