ethyl 5-ethyl-2-[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[(E)-3-(2-nitrophenyl)acryloyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H20N2O7S/c1-3-14-11-15(20(25)28-4-2)19(30-14)21-17(23)12-29-18(24)10-9-13-7-5-6-8-16(13)22(26)27/h5-11H,3-4,12H2,1-2H3,(H,21,23)/b10-9+