2-chloranyl-N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(3R)-1,1-diketo-3-methyl-thiolan-3-yl]-4-nitro-benzamide Formula: C12H13ClN2O5S MolecularWeight: 332.76002

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O5S/c1-12(4-5-21(19,20)7-12)14-11(16)9-3-2-8(15(17)18)6-10(9)13/h2-3,6H,4-5,7H2,1H3,(H,14,16)/t12-/m1/s1