ethyl 2-[[1-acetamido-2,2,2-tris(chloranyl)ethyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-acetamido-2,2,2-tris(chloranyl)ethyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1-acetamido-2,2,2-trichloro-ethyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(1-acetamido-2,2,2-trichloroethyl)amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-acetamido-2,2,2-trichloroethyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(1-acetamido-2,2,2-trichloro-ethyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H17Cl3N2O3S MolecularWeight: 435.75248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(C(Cl)(Cl)Cl)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(C(Cl)(Cl)Cl)NC(=O)C

InChI

InChI=1S/C17H17Cl3N2O3S/c1-3-25-15(24)13-12(11-7-5-4-6-8-11)9-26-14(13)22-16(17(18,19)20)21-10(2)23/h4-9,16,22H,3H2,1-2H3,(H,21,23)