methyl (4R,5S)-2-methyl-6-methylidene-7-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1-benzothiophene-5-carboxylate

Systemtic Name: methyl (4R,5S)-2-methyl-6-methylidene-7-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1-benzothiophene-5-carboxylate Openeye Name: methyl (4R,5S)-2-methyl-6-methylene-7-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzothiophene-5-carboxylate CAS Name: (4R,5S)-2-methyl-6-methylene-7-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1-benzothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-2-methyl-6-methylidene-7-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1-benzothiophene-5-carboxylate Traditional Name: (4R,5S)-7-keto-2-methyl-6-methylene-4-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzothiophene-5-carboxylic acid methyl ester Formula: C21H22O6S MolecularWeight: 402.46078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)C(=O)C(=C)C(C2C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC

Isomeric SMILES

CC1=CC2=C(S1)C(=O)C(=C)[C@H]([C@@H]2C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC

InChI

InChI=1S/C21H22O6S/c1-10-7-13-17(12-8-14(24-3)19(26-5)15(9-12)25-4)16(21(23)27-6)11(2)18(22)20(13)28-10/h7-9,16-17H,2H2,1,3-6H3/t16-,17-/m1/s1