N-[4-(chloromethyl)-2-nitro-phenyl]-N-methyl-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-[4-(chloromethyl)-2-nitro-phenyl]-N-methyl-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-[4-(chloromethyl)-2-nitro-phenyl]-N-methyl-1,1-dioxo-thiolan-3-amine CAS Name: N-[4-(chloromethyl)-2-nitrophenyl]-N-methyl-1,1-dioxo-3-thiolanamine IUPAC Name: N-[4-(chloromethyl)-2-nitrophenyl]-N-methyl-1,1-dioxothiolan-3-amine Traditional Name: [4-(chloromethyl)-2-nitro-phenyl]-(1,1-diketothiolan-3-yl)-methyl-amine Formula: C12H15ClN2O4S MolecularWeight: 318.7765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O4S/c1-14(10-4-5-20(18,19)8-10)11-3-2-9(7-13)6-12(11)15(16)17/h2-3,6,10H,4-5,7-8H2,1H3