methyl 3-[2-methoxy-4-(3-thiophen-3-ylphenyl)phenyl]propanoate

Systemtic Name: methyl 3-[2-methoxy-4-(3-thiophen-3-ylphenyl)phenyl]propanoate Openeye Name: methyl 3-[2-methoxy-4-[3-(3-thienyl)phenyl]phenyl]propanoate CAS Name: 3-[2-methoxy-4-[3-(3-thiophenyl)phenyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-methoxy-4-(3-thiophen-3-ylphenyl)phenyl]propanoate Traditional Name: 3-[2-methoxy-4-[3-(3-thienyl)phenyl]phenyl]propionic acid methyl ester Formula: C21H20O3S MolecularWeight: 352.4467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CSC=C3)CCC(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=CSC=C3)CCC(=O)OC

InChI

InChI=1S/C21H20O3S/c1-23-20-13-18(7-6-15(20)8-9-21(22)24-2)16-4-3-5-17(12-16)19-10-11-25-14-19/h3-7,10-14H,8-9H2,1-2H3