N-(4-methoxy-2-nitro-phenyl)-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-(4-methoxy-2-nitro-phenyl)-1,1-dioxo-thian-4-amine CAS Name: N-(4-methoxy-2-nitrophenyl)-1,1-dioxo-4-thianamine IUPAC Name: N-(4-methoxy-2-nitrophenyl)-1,1-dioxothian-4-amine Traditional Name: (1,1-diketothian-4-yl)-(4-methoxy-2-nitro-phenyl)amine Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2CCS(=O)(=O)CC2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC2CCS(=O)(=O)CC2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O5S/c1-19-10-2-3-11(12(8-10)14(15)16)13-9-4-6-20(17,18)7-5-9/h2-3,8-9,13H,4-7H2,1H3