ethyl 3-[2-(4-chloranyl-3-nitro-phenyl)carbonyloxyethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(4-chloranyl-3-nitro-phenyl)carbonyloxyethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(4-chloro-3-nitro-benzoyl)oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(4-chloro-3-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-chloro-3-nitrobenzoyl)oxyacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(4-chloro-3-nitro-benzoyl)oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H17ClN2O7S MolecularWeight: 488.89758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=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)20-16(11-18(33-20)13-6-4-3-5-7-13)24-19(26)12-32-21(27)14-8-9-15(23)17(10-14)25(29)30/h3-11H,2,12H2,1H3,(H,24,26)