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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N[C@H]2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O6S/c1-9-2-3-12(11(6-9)15(17)18)21-7-13(16)14-10-4-5-22(19,20)8-10/h2-3,6,10H,4-5,7-8H2,1H3,(H,14,16)/t10-/m0/s1