2-(2-phenoxybutanoylamino)ethyl nitrate

Systemtic Name: 2-(2-phenoxybutanoylamino)ethyl nitrate Openeye Name: 2-(2-phenoxybutanoylamino)ethyl nitrate CAS Name: nitric acid 2-[(1-oxo-2-phenoxybutyl)amino]ethyl ester IUPAC Name: 2-(2-phenoxybutanoylamino)ethyl nitrate Traditional Name: nitric acid 2-(2-phenoxybutanoylamino)ethyl ester Formula: C12H16N2O5 MolecularWeight: 268.26584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCO[N+](=O)[O-])OC1=CC=CC=C1

Isomeric SMILES

CCC(C(=O)NCCO[N+](=O)[O-])OC1=CC=CC=C1

InChI

InChI=1S/C12H16N2O5/c1-2-11(19-10-6-4-3-5-7-10)12(15)13-8-9-18-14(16)17/h3-7,11H,2,8-9H2,1H3,(H,13,15)