ethyl 4-(2-methylpropyl)-2-[2-(5-nitrothiophen-2-yl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[2-(5-nitrothiophen-2-yl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[[2-(5-nitrothiophene-2-carbonyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-methylpropyl)-2-[[2-[(5-nitro-2-thiophenyl)-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylpropyl)-2-[[2-(5-nitrothiophene-2-carbonyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[[2-(5-nitrothiophene-2-carbonyl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O7S2 MolecularWeight: 440.4906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O7S2/c1-4-26-18(23)15-11(7-10(2)3)9-28-16(15)19-13(21)8-27-17(22)12-5-6-14(29-12)20(24)25/h5-6,9-10H,4,7-8H2,1-3H3,(H,19,21)