methyl 2-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-chloro-4-nitro-benzoyl)amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-4-nitrobenzoyl)amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[(2-chloro-4-nitro-benzoyl)amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C16H15ClN2O5S MolecularWeight: 382.8187

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

InChI

InChI=1S/C16H15ClN2O5S/c1-3-4-10-8-12(16(21)24-2)15(25-10)18-14(20)11-6-5-9(19(22)23)7-13(11)17/h5-8H,3-4H2,1-2H3,(H,18,20)