ethyl 4-[2-(4-ethoxycarbonylphenyl)-1-benzothiophen-3-yl]benzoate

Systemtic Name: ethyl 4-[2-(4-ethoxycarbonylphenyl)-1-benzothiophen-3-yl]benzoate Openeye Name: ethyl 4-[2-(4-ethoxycarbonylphenyl)benzothiophen-3-yl]benzoate CAS Name: 4-[2-(4-ethoxycarbonylphenyl)-1-benzothiophen-3-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-ethoxycarbonylphenyl)-1-benzothiophen-3-yl]benzoate Traditional Name: 4-[2-(4-carbethoxyphenyl)benzothiophen-3-yl]benzoic acid ethyl ester Formula: C26H22O4S MolecularWeight: 430.51548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C26H22O4S/c1-3-29-25(27)19-13-9-17(10-14-19)23-21-7-5-6-8-22(21)31-24(23)18-11-15-20(16-12-18)26(28)30-4-2/h5-16H,3-4H2,1-2H3