5-ethyl-5-nitro-2-oxidanylidene-N-(pyridin-4-ylmethyl)-1,3,2$l^{5}-dioxaphosphinan-2-amine

Systemtic Name: 5-ethyl-5-nitro-2-oxidanylidene-N-(pyridin-4-ylmethyl)-1,3,2$l^{5}-dioxaphosphinan-2-amine Openeye Name: 5-ethyl-5-nitro-2-oxo-N-(4-pyridylmethyl)-1,3,2$l^{5}-dioxaphosphinan-2-amine CAS Name: 5-ethyl-5-nitro-2-oxo-N-(pyridin-4-ylmethyl)-1,3,2$l^{5}-dioxaphosphorinan-2-amine IUPAC Name: 5-ethyl-5-nitro-2-oxo-N-(pyridin-4-ylmethyl)-1,3,2$l^{5}-dioxaphosphinan-2-amine Traditional Name: (5-ethyl-2-keto-5-nitro-1,3,2$l^{5}-dioxaphosphorinan-2-yl)-(4-pyridylmethyl)amine Formula: C11H16N3O5P MolecularWeight: 301.235601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(COP(=O)(OC1)NCC2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1(COP(=O)(OC1)NCC2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N3O5P/c1-2-11(14(15)16)8-18-20(17,19-9-11)13-7-10-3-5-12-6-4-10/h3-6H,2,7-9H2,1H3,(H,13,17)