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

Systemtic Name: propan-2-yl 2-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

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