[1-azanyl-3-(4-nitrophenoxy)butan-2-yl] ethanoate

Systemtic Name: [1-azanyl-3-(4-nitrophenoxy)butan-2-yl] ethanoate Openeye Name: [1-(aminomethyl)-2-(4-nitrophenoxy)propyl] acetate CAS Name: acetic acid [1-amino-3-(4-nitrophenoxy)butan-2-yl] ester IUPAC Name: [1-amino-3-(4-nitrophenoxy)butan-2-yl] acetate Traditional Name: acetic acid [1-(aminomethyl)-2-(4-nitrophenoxy)propyl] ester Formula: C12H16N2O5 MolecularWeight: 268.26584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN)OC(=O)C)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C(CN)OC(=O)C)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

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