[2-(4-methoxyphenyl)-1-nitrooxy-propan-2-yl] ethanoate

Systemtic Name: [2-(4-methoxyphenyl)-1-nitrooxy-propan-2-yl] ethanoate Openeye Name: [1-(4-methoxyphenyl)-1-methyl-2-nitrooxy-ethyl] acetate CAS Name: acetic acid [2-(4-methoxyphenyl)-1-nitrooxypropan-2-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-1-nitrooxypropan-2-yl] acetate Traditional Name: acetic acid [1-(4-methoxyphenyl)-1-methyl-2-nitrooxy-ethyl] ester Formula: C12H15NO6 MolecularWeight: 269.2506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(CO[N+](=O)[O-])C1=CC=C(C=C1)OC

Isomeric SMILES

CC(=O)OC(C)(CO[N+](=O)[O-])C1=CC=C(C=C1)OC

InChI

InChI=1S/C12H15NO6/c1-9(14)19-12(2,8-18-13(15)16)10-4-6-11(17-3)7-5-10/h4-7H,8H2,1-3H3