methyl 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[(E)-3-(4-nitrophenyl)acryloyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N2O5S/c1-4-14-11(2)26-17(16(14)18(22)25-3)19-15(21)10-7-12-5-8-13(9-6-12)20(23)24/h5-10H,4H2,1-3H3,(H,19,21)/b10-7+