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

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[(E)-3-(5-nitro-2-furyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C=CC2=CC=C(O2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O6S/c1-4-12-10(3)26-16(15(12)17(21)24-5-2)18-13(20)8-6-11-7-9-14(25-11)19(22)23/h6-9H,4-5H2,1-3H3,(H,18,20)/b8-6+