ethyl 2-[2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H21N3O9S2 MolecularWeight: 499.51474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O9S2/c1-2-30-19(24)14-5-10-32-18(14)20-17(23)12-31-16-4-3-13(11-15(16)22(25)26)33(27,28)21-6-8-29-9-7-21/h3-5,10-11H,2,6-9,12H2,1H3,(H,20,23)