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

Systemtic Name: [2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Openeye Name: [2-(2,4-dimethylphenyl)-2-oxo-ethyl] 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylate CAS Name: 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylic acid [2-(2,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-2-oxoethyl] 7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate Traditional Name: 7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxylic acid [2-(2,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C24H22O4S MolecularWeight: 406.49408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)COC(=O)C2=CC3=C(S2)C4=C(CC3)C=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)COC(=O)C2=CC3=C(S2)C4=C(CC3)C=C(C=C4)OC)C

InChI

InChI=1S/C24H22O4S/c1-14-4-8-19(15(2)10-14)21(25)13-28-24(26)22-12-17-6-5-16-11-18(27-3)7-9-20(16)23(17)29-22/h4,7-12H,5-6,13H2,1-3H3