dimethyl 4-phenyl-1-benzothiophene-6,7-dicarboxylate

Systemtic Name: dimethyl 4-phenyl-1-benzothiophene-6,7-dicarboxylate Openeye Name: dimethyl 4-phenylbenzothiophene-6,7-dicarboxylate CAS Name: 4-phenyl-1-benzothiophene-6,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-phenyl-1-benzothiophene-6,7-dicarboxylate Traditional Name: 4-phenylbenzothiophene-6,7-dicarboxylic acid dimethyl ester Formula: C18H14O4S MolecularWeight: 326.36636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CS2)C(=C1)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CS2)C(=C1)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H14O4S/c1-21-17(19)14-10-13(11-6-4-3-5-7-11)12-8-9-23-16(12)15(14)18(20)22-2/h3-10H,1-2H3