N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-chloranyl-4-nitro-phenoxy)-N-methyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-chloranyl-4-nitro-phenoxy)-N-methyl-ethanamide Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide CAS Name: 2-(2-chloro-4-nitrophenoxy)-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylacetamide IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylacetamide Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-acetamide Formula: C13H15ClN2O6S MolecularWeight: 362.786

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H15ClN2O6S/c1-15(10-4-5-23(20,21)8-10)13(17)7-22-12-3-2-9(16(18)19)6-11(12)14/h2-3,6,10H,4-5,7-8H2,1H3/t10-/m0/s1