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

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-(phenylmethyl)-(1,3-thiazinan-2-ylidene)azanium Openeye Name: benzyl-[2-(3-nitrophenyl)-2-oxo-ethyl]-(1,3-thiazinan-2-ylidene)ammonium CAS Name: [2-(3-nitrophenyl)-2-oxoethyl]-(phenylmethyl)-(1,3-thiazinan-2-ylidene)ammonium IUPAC Name: benzyl-[2-(3-nitrophenyl)-2-oxoethyl]-(1,3-thiazinan-2-ylidene)azanium Traditional Name: benzyl-[2-keto-2-(3-nitrophenyl)ethyl]-(1,3-thiazinan-2-ylidene)ammonium Formula: C19H20N3O3S+ MolecularWeight: 370.4454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=[N+](CC2=CC=CC=C2)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-])SC1

Isomeric SMILES

C1CNC(=[N+](CC2=CC=CC=C2)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-])SC1

InChI

InChI=1S/C19H19N3O3S/c23-18(16-8-4-9-17(12-16)22(24)25)14-21(19-20-10-5-11-26-19)13-15-6-2-1-3-7-15/h1-4,6-9,12H,5,10-11,13-14H2/p+1