ethyl 2-[2,2-bis(chloranyl)ethanoylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2,2-bis(chloranyl)ethanoylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2,2-dichloroacetyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[(2,2-dichloro-1-oxoethyl)amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,2-dichloroacetyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2,2-dichloroacetyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H17Cl2NO4S MolecularWeight: 402.29218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(Cl)Cl

InChI

InChI=1S/C17H17Cl2NO4S/c1-3-23-11-7-5-10(6-8-11)12-9-25-16(20-15(21)14(18)19)13(12)17(22)24-4-2/h5-9,14H,3-4H2,1-2H3,(H,20,21)