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

Systemtic Name: propan-2-yl 2-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 2-[(4-chloro-2-nitro-benzoyl)amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(4-chloro-2-nitrobenzoyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-2-nitro-benzoyl)amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C18H19ClN2O5S/c1-5-12-10(4)27-17(15(12)18(23)26-9(2)3)20-16(22)13-7-6-11(19)8-14(13)21(24)25/h6-9H,5H2,1-4H3,(H,20,22)