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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-isobutyl-3-nitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-isobutyl-3-nitro-benzamide Formula: C15H20N2O5S MolecularWeight: 340.3947

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5S/c1-11(2)9-16(14-6-7-23(21,22)10-14)15(18)12-4-3-5-13(8-12)17(19)20/h3-5,8,11,14H,6-7,9-10H2,1-2H3/t14-/m0/s1