[(2R)-1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [(2R)-1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-nitrothiophene-2-carboxylate Openeye Name: [(1R)-2-(2,4-dichloroanilino)-1-methyl-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [(2R)-1-(2,4-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,4-dichloroanilino)-1-oxopropan-2-yl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [(1R)-2-(2,4-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C14H10Cl2N2O5S MolecularWeight: 389.2106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C14H10Cl2N2O5S/c1-7(13(19)17-10-3-2-8(15)6-9(10)16)23-14(20)11-4-5-12(24-11)18(21)22/h2-7H,1H3,(H,17,19)/t7-/m1/s1