methyl 2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C21H17Cl2NO4S MolecularWeight: 450.33498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OC)OC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OC)OC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H17Cl2NO4S/c1-12(28-17-9-8-14(22)10-16(17)23)19(25)24-20-18(21(26)27-2)15(11-29-20)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,24,25)