N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dinitro-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dinitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-3,5-dinitrobenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dinitrobenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-3,5-dinitro-benzamide Formula: C11H11N3O7S MolecularWeight: 329.28594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O7S/c15-11(12-8-1-2-22(20,21)6-8)7-3-9(13(16)17)5-10(4-7)14(18)19/h3-5,8H,1-2,6H2,(H,12,15)/t8-/m0/s1