ethyl 4-methyl-2-[(4-nitrophenyl)carbonylamino]-5-propanoyloxy-thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(4-nitrophenyl)carbonylamino]-5-propanoyloxy-thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(4-nitrobenzoyl)amino]-5-propanoyloxy-thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-5-(1-oxopropoxy)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(4-nitrobenzoyl)amino]-5-propanoyloxythiophene-3-carboxylate Traditional Name: 4-methyl-2-[(4-nitrobenzoyl)amino]-5-propionyloxy-thiophene-3-carboxylic acid ethyl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC)C

Isomeric SMILES

CCC(=O)OC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC)C

InChI

InChI=1S/C18H18N2O7S/c1-4-13(21)27-18-10(3)14(17(23)26-5-2)16(28-18)19-15(22)11-6-8-12(9-7-11)20(24)25/h6-9H,4-5H2,1-3H3,(H,19,22)