ethyl 5-methyl-4-(4-nitrophenyl)-2-(phenoxycarbonylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(phenoxycarbonylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(phenoxycarbonylamino)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-nitrophenyl)-2-[[oxo(phenoxy)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-(phenoxycarbonylamino)thiophene-3-carboxylate Traditional Name: 2-(carbophenoxyamino)-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O6S/c1-3-28-20(24)18-17(14-9-11-15(12-10-14)23(26)27)13(2)30-19(18)22-21(25)29-16-7-5-4-6-8-16/h4-12H,3H2,1-2H3,(H,22,25)