ethyl 2-[2-(3-nitrophenoxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-nitrophenoxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[[2-(3-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-nitrophenoxy)acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-(3-nitrophenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O6S/c1-4-25-18(22)14-9-15(11(2)3)27-17(14)19-16(21)10-26-13-7-5-6-12(8-13)20(23)24/h5-9,11H,4,10H2,1-3H3,(H,19,21)