ethyl 2-[2-(4-ethoxyphenyl)ethanoylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-ethoxyphenyl)ethanoylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-ethoxyphenyl)acetyl]amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[2-(4-ethoxyphenyl)-1-oxoethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-ethoxyphenyl)acetyl]amino]-5-nitrothiophene-3-carboxylate Traditional Name: 5-nitro-2-[(2-p-phenetylacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)NC2=C(C=C(S2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)NC2=C(C=C(S2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C17H18N2O6S/c1-3-24-12-7-5-11(6-8-12)9-14(20)18-16-13(17(21)25-4-2)10-15(26-16)19(22)23/h5-8,10H,3-4,9H2,1-2H3,(H,18,20)