diethyl 3-methyl-5-[2-[(E)-3-(3-nitrophenyl)prop-2-enoyl]oxyethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-[(E)-3-(3-nitrophenyl)prop-2-enoyl]oxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[(E)-3-(3-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[(E)-3-(3-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[(E)-3-(3-nitrophenyl)acryloyl]oxyacetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H22N2O9S MolecularWeight: 490.48308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O9S/c1-4-31-21(27)18-13(3)19(22(28)32-5-2)34-20(18)23-16(25)12-33-17(26)10-9-14-7-6-8-15(11-14)24(29)30/h6-11H,4-5,12H2,1-3H3,(H,23,25)/b10-9+