dimethyl 2-[[3-methoxy-2-(2-thiophen-3-ylethyl)phenyl]methyl]propanedioate

Systemtic Name: dimethyl 2-[[3-methoxy-2-(2-thiophen-3-ylethyl)phenyl]methyl]propanedioate Openeye Name: dimethyl 2-[[3-methoxy-2-[2-(3-thienyl)ethyl]phenyl]methyl]propanedioate CAS Name: 2-[[3-methoxy-2-[2-(3-thiophenyl)ethyl]phenyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[3-methoxy-2-(2-thiophen-3-ylethyl)phenyl]methyl]propanedioate Traditional Name: 2-[3-methoxy-2-[2-(3-thienyl)ethyl]benzyl]malonic acid dimethyl ester Formula: C19H22O5S MolecularWeight: 362.43998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CCC2=CSC=C2)CC(C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1CCC2=CSC=C2)CC(C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H22O5S/c1-22-17-6-4-5-14(11-16(18(20)23-2)19(21)24-3)15(17)8-7-13-9-10-25-12-13/h4-6,9-10,12,16H,7-8,11H2,1-3H3