(4-methoxycarbonylphenyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid (4-carbomethoxyphenyl) ester Formula: C22H18O5S MolecularWeight: 394.44032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)OC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=O)OC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H18O5S/c1-25-17-9-10-18-14(11-17)3-4-15-12-19(28-20(15)18)22(24)27-16-7-5-13(6-8-16)21(23)26-2/h5-12H,3-4H2,1-2H3