[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-phenyl-(1,3-thiazinan-2-ylidene)azanium

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-phenyl-(1,3-thiazinan-2-ylidene)azanium Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl]-phenyl-(1,3-thiazinan-2-ylidene)ammonium CAS Name: [2-(3-nitrophenyl)-2-oxoethyl]-phenyl-(1,3-thiazinan-2-ylidene)ammonium IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl]-phenyl-(1,3-thiazinan-2-ylidene)azanium Traditional Name: [2-keto-2-(3-nitrophenyl)ethyl]-phenyl-(1,3-thiazinan-2-ylidene)ammonium Formula: C18H18N3O3S+ MolecularWeight: 356.41882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=[N+](CC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)SC1

Isomeric SMILES

C1CNC(=[N+](CC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)SC1

InChI

InChI=1S/C18H17N3O3S/c22-17(14-6-4-9-16(12-14)21(23)24)13-20(15-7-2-1-3-8-15)18-19-10-5-11-25-18/h1-4,6-9,12H,5,10-11,13H2/p+1