ethyl 2-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-ethoxycarbonyl-5-nitro-benzoyl)amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-ethoxycarbonyl-5-nitrobenzoyl)amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(3-carbethoxy-5-nitro-benzoyl)amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C19H20N2O7S/c1-4-14-10-15(19(24)28-6-3)17(29-14)20-16(22)11-7-12(18(23)27-5-2)9-13(8-11)21(25)26/h7-10H,4-6H2,1-3H3,(H,20,22)