ethyl 2-(3-chloranylpropanoylamino)-4-(3-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(3-chloranylpropanoylamino)-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(3-chloropropanoylamino)-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[(3-chloro-1-oxopropyl)amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chloropropanoylamino)-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-(3-chloropropanoylamino)-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C16H15ClN2O5S MolecularWeight: 382.8187

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CCCl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)CCCl

InChI

InChI=1S/C16H15ClN2O5S/c1-2-24-16(21)14-12(9-25-15(14)18-13(20)6-7-17)10-4-3-5-11(8-10)19(22)23/h3-5,8-9H,2,6-7H2,1H3,(H,18,20)