[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-oxolane-2-carboxylate

Systemtic Name: [2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2R)-oxolane-2-carboxylate Openeye Name: [2-(2,3-dimethyl-6-nitro-anilino)-2-oxo-ethyl] (2R)-tetrahydrofuran-2-carboxylate CAS Name: (2R)-2-oxolanecarboxylic acid [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl] (2R)-oxolane-2-carboxylate Traditional Name: (2R)-tetrahydrofuran-2-carboxylic acid [2-(2,3-dimethyl-6-nitro-anilino)-2-keto-ethyl] ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)C2CCCO2)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)COC(=O)[C@H]2CCCO2)C

InChI

InChI=1S/C15H18N2O6/c1-9-5-6-11(17(20)21)14(10(9)2)16-13(18)8-23-15(19)12-4-3-7-22-12/h5-6,12H,3-4,7-8H2,1-2H3,(H,16,18)/t12-/m1/s1