ethyl 2-[2-(4-chloranyl-3-nitro-phenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-chloranyl-3-nitro-phenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-chloro-3-nitro-benzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-chloro-3-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-chloro-3-nitrobenzoyl)oxyacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-chloro-3-nitro-benzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H17ClN2O7S MolecularWeight: 488.89758

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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)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H17ClN2O7S/c1-2-31-22(28)19-15(13-6-4-3-5-7-13)12-33-20(19)24-18(26)11-32-21(27)14-8-9-16(23)17(10-14)25(29)30/h3-10,12H,2,11H2,1H3,(H,24,26)