[2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-chloranyl-4-nitro-benzoate Openeye Name: [2-oxo-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-oxo-2-[[(2S)-2-oxolanyl]methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [2-keto-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl] ester Formula: C14H15ClN2O6 MolecularWeight: 342.7317

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1C[C@H](OC1)CNC(=O)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN2O6/c15-12-6-9(17(20)21)3-4-11(12)14(19)23-8-13(18)16-7-10-2-1-5-22-10/h3-4,6,10H,1-2,5,7-8H2,(H,16,18)/t10-/m0/s1