dipropan-2-yl 3-methyl-5-[2-(4-nitrophenyl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dipropan-2-yl 3-methyl-5-[2-(4-nitrophenyl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diisopropyl 3-methyl-5-[[2-(4-nitrophenyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(4-nitrophenyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-methyl-5-[[2-(4-nitrophenyl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(4-nitrophenyl)acetyl]amino]thiophene-2,4-dicarboxylic acid diisopropyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C21H24N2O7S/c1-11(2)29-20(25)17-13(5)18(21(26)30-12(3)4)31-19(17)22-16(24)10-14-6-8-15(9-7-14)23(27)28/h6-9,11-12H,10H2,1-5H3,(H,22,24)