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

Systemtic Name: ethyl 2-[(2-iodanylphenyl)carbonylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-iodobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[(2-iodophenyl)-oxomethyl]amino]-5-methyl-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-iodobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-iodobenzoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H17IN2O5S MolecularWeight: 536.33955

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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)C3=CC=CC=C3I

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C21H17IN2O5S/c1-3-29-21(26)18-17(13-8-10-14(11-9-13)24(27)28)12(2)30-20(18)23-19(25)15-6-4-5-7-16(15)22/h4-11H,3H2,1-2H3,(H,23,25)