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

Systemtic Name: ethyl 2-[2-[4-(dimethylamino)-3-nitro-phenyl]carbonyloxyethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(dimethylamino)-3-nitro-benzoyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[4-(dimethylamino)-3-nitrophenyl]-oxomethoxy]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(dimethylamino)-3-nitrobenzoyl]oxyacetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(dimethylamino)-3-nitro-benzoyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-5-13-10-14(20(26)29-6-2)18(31-13)21-17(24)11-30-19(25)12-7-8-15(22(3)4)16(9-12)23(27)28/h7-10H,5-6,11H2,1-4H3,(H,21,24)