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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N-isobutyl-3-nitro-benzamide CAS Name: 4-chloro-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-[(3S)-1,1-diketothiolan-3-yl]-N-isobutyl-3-nitro-benzamide Formula: C15H19ClN2O5S MolecularWeight: 374.83976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN2O5S/c1-10(2)8-17(12-5-6-24(22,23)9-12)15(19)11-3-4-13(16)14(7-11)18(20)21/h3-4,7,10,12H,5-6,8-9H2,1-2H3/t12-/m0/s1