N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-methylpropyl)-3,5-dinitro-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-methylpropyl)-3,5-dinitro-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-isobutyl-3,5-dinitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-(2-methylpropyl)-3,5-dinitrobenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methylpropyl)-3,5-dinitrobenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-isobutyl-3,5-dinitro-benzamide Formula: C15H19N3O7S MolecularWeight: 385.39226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O7S/c1-10(2)8-16(12-3-4-26(24,25)9-12)15(19)11-5-13(17(20)21)7-14(6-11)18(22)23/h5-7,10,12H,3-4,8-9H2,1-2H3/t12-/m0/s1