ethyl 2-benzamido-5-nitro-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-benzamido-5-nitro-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-benzamido-5-nitro-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-benzamido-5-nitro-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzamido-5-nitro-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-benzamido-5-nitro-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H15N3O7S MolecularWeight: 441.414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O7S/c1-2-30-20(25)16-15(12-8-10-14(11-9-12)22(26)27)19(23(28)29)31-18(16)21-17(24)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,21,24)