ethyl 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-4-(4-nitrophenyl)-2-[(3-nitrophenyl)sulfonylamino]thiophene-3-carboxylic acid ethyl ester Formula: C20H17N3O8S2 MolecularWeight: 491.49428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O8S2/c1-3-31-20(24)18-17(13-7-9-14(10-8-13)22(25)26)12(2)32-19(18)21-33(29,30)16-6-4-5-15(11-16)23(27)28/h4-11,21H,3H2,1-2H3