ethyl 2-[2-(3,5-dinitrophenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3,5-dinitrophenyl)carbonyloxyethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(3,5-dinitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H17N3O9S MolecularWeight: 499.45008

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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(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H17N3O9S/c1-2-33-22(28)19-17(13-6-4-3-5-7-13)12-35-20(19)23-18(26)11-34-21(27)14-8-15(24(29)30)10-16(9-14)25(31)32/h3-10,12H,2,11H2,1H3,(H,23,26)