[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-propyl-2-thiophenecarboxylic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-ethyl-5-propylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-propyl-thiophene-2-carboxylic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC(=C(C=C2)OC)OC)CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC(=C(C=C2)OC)OC)CC

InChI

InChI=1S/C20H25NO5S/c1-5-7-17-13(6-2)10-18(27-17)20(23)26-12-19(22)21-14-8-9-15(24-3)16(11-14)25-4/h8-11H,5-7,12H2,1-4H3,(H,21,22)