ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-fluorophenyl)sulfonyl-amino]propanoate

Systemtic Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-fluorophenyl)sulfonyl-amino]propanoate Openeye Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-fluorophenyl)sulfonyl-amino]propanoate CAS Name: 3-[(3,4-dimethoxyphenyl)methyl-(4-fluorophenyl)sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-fluorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-fluorophenyl)sulfonyl-veratryl-amino]propionic acid ethyl ester Formula: C20H24FNO6S MolecularWeight: 425.471063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCN(CC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H24FNO6S/c1-4-28-20(23)11-12-22(29(24,25)17-8-6-16(21)7-9-17)14-15-5-10-18(26-2)19(13-15)27-3/h5-10,13H,4,11-12,14H2,1-3H3