ethyl 3-(4-methoxycarbonylphenyl)-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 3-(4-methoxycarbonylphenyl)-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Openeye Name: ethyl 3-(4-methoxycarbonylphenyl)-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylate CAS Name: 3-(4-methoxycarbonylphenyl)-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-methoxycarbonylphenyl)-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Traditional Name: 3-(4-carbomethoxyphenyl)-4-keto-6,7-dihydro-5H-isobenzothiophene-1-carboxylic acid ethyl ester Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCC(=O)C2=C(S1)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=C2CCCC(=O)C2=C(S1)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18O5S/c1-3-24-19(22)17-13-5-4-6-14(20)15(13)16(25-17)11-7-9-12(10-8-11)18(21)23-2/h7-10H,3-6H2,1-2H3