N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-N',N'-dimethyl-3-nitro-benzohydrazide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-N',N'-dimethyl-3-nitro-benzohydrazide Openeye Name: 4-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N',N'-dimethyl-3-nitro-benzohydrazide CAS Name: 4-chloro-N-[(3S)-1,1-dioxo-3-thiolanyl]-N',N'-dimethyl-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N',N'-dimethyl-3-nitrobenzohydrazide Traditional Name: 4-chloro-N-[(3S)-1,1-diketothiolan-3-yl]-N',N'-dimethyl-3-nitro-benzohydrazide Formula: C13H16ClN3O5S MolecularWeight: 361.80124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3O5S/c1-15(2)16(10-5-6-23(21,22)8-10)13(18)9-3-4-11(14)12(7-9)17(19)20/h3-4,7,10H,5-6,8H2,1-2H3/t10-/m0/s1