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

Systemtic Name: ethyl 2-[2-(3,5-dinitrophenyl)carbonyloxyethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(3,5-dinitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(3,5-dinitrobenzoyl)oxyacetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H19N3O9S MolecularWeight: 513.47666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O9S/c1-3-34-23(29)20-18(14-6-4-13(2)5-7-14)12-36-21(20)24-19(27)11-35-22(28)15-8-16(25(30)31)10-17(9-15)26(32)33/h4-10,12H,3,11H2,1-2H3,(H,24,27)