(2-methoxy-5-methyl-phenyl)methyl (5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl (5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl (5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: (5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl (5R)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: (5R)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (2-methoxy-5-methyl-benzyl) ester Formula: C19H22O3S MolecularWeight: 330.44118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)OCC3=C(C=CC(=C3)C)OC

Isomeric SMILES

C[C@@H]1CCC2=C(C1)C=C(S2)C(=O)OCC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C19H22O3S/c1-12-4-6-16(21-3)15(9-12)11-22-19(20)18-10-14-8-13(2)5-7-17(14)23-18/h4,6,9-10,13H,5,7-8,11H2,1-3H3/t13-/m1/s1