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

Systemtic Name: propyl 2-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: propyl 2-[(4-chloro-2-nitro-benzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[(4-chloro-2-nitrobenzoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-2-nitro-benzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid propyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O5S/c1-4-7-25-17(22)14-9(2)10(3)26-16(14)19-15(21)12-6-5-11(18)8-13(12)20(23)24/h5-6,8H,4,7H2,1-3H3,(H,19,21)