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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-chloranyl-N-ethyl-3-nitro-benzamide Openeye Name: 4-chloro-N-(1,1-dioxothiolan-3-yl)-N-ethyl-3-nitro-benzamide CAS Name: 4-chloro-N-(1,1-dioxo-3-thiolanyl)-N-ethyl-3-nitrobenzamide IUPAC Name: 4-chloro-N-(1,1-dioxothiolan-3-yl)-N-ethyl-3-nitrobenzamide Traditional Name: 4-chloro-N-(1,1-diketothiolan-3-yl)-N-ethyl-3-nitro-benzamide Formula: C13H15ClN2O5S MolecularWeight: 346.7866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2O5S/c1-2-15(10-5-6-22(20,21)8-10)13(17)9-3-4-11(14)12(7-9)16(18)19/h3-4,7,10H,2,5-6,8H2,1H3