O4-ethyl O2-propan-2-yl 3-methyl-5-[(4-methyl-3-nitro-phenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-[(4-methyl-3-nitro-phenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-[(4-methyl-3-nitro-benzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 3-methyl-5-[(4-methyl-3-nitrobenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(4-methyl-3-nitro-benzoyl)amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O7S/c1-6-28-19(24)15-12(5)16(20(25)29-10(2)3)30-18(15)21-17(23)13-8-7-11(4)14(9-13)22(26)27/h7-10H,6H2,1-5H3,(H,21,23)