ethyl 2-[2-[3,4-bis(oxidanyl)phenyl]carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3,4-bis(oxidanyl)phenyl]carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,4-dihydroxybenzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(3,4-dihydroxyphenyl)-oxomethoxy]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,4-dihydroxybenzoyl)oxyacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-[(2-protocatechuoyloxyacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H19NO7S MolecularWeight: 441.45376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C22H19NO7S/c1-2-29-22(28)19-15(13-6-4-3-5-7-13)12-31-20(19)23-18(26)11-30-21(27)14-8-9-16(24)17(25)10-14/h3-10,12,24-25H,2,11H2,1H3,(H,23,26)