methyl 2-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]-4-(4-fluorophenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid methyl ester Formula: C22H19ClFNO4S MolecularWeight: 447.906963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClFNO4S/c1-22(2,29-16-10-6-14(23)7-11-16)21(27)25-19-18(20(26)28-3)17(12-30-19)13-4-8-15(24)9-5-13/h4-12H,1-3H3,(H,25,27)