2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[(3S)-1,1-dioxo-3-thiolanyl]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[(3S)-1,1-diketothiolan-3-yl]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CC2CCS(=O)(=O)C2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C13H16N2O6S/c1-21-12-7-10(15(17)18)2-3-11(12)14-13(16)6-9-4-5-22(19,20)8-9/h2-3,7,9H,4-6,8H2,1H3,(H,14,16)/t9-/m1/s1