ethyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[4-(2,4-dichlorophenoxy)butanoylamino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21Cl2NO4S MolecularWeight: 430.34534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C19H21Cl2NO4S/c1-3-13-11-14(19(24)25-4-2)18(27-13)22-17(23)6-5-9-26-16-8-7-12(20)10-15(16)21/h7-8,10-11H,3-6,9H2,1-2H3,(H,22,23)