[1-(6-nitrohexyl)-4-phenyl-piperidin-4-yl] ethanoate

Systemtic Name: [1-(6-nitrohexyl)-4-phenyl-piperidin-4-yl] ethanoate Openeye Name: [1-(6-nitrohexyl)-4-phenyl-4-piperidyl] acetate CAS Name: acetic acid [1-(6-nitrohexyl)-4-phenyl-4-piperidinyl] ester IUPAC Name: [1-(6-nitrohexyl)-4-phenylpiperidin-4-yl] acetate Traditional Name: acetic acid [1-(6-nitrohexyl)-4-phenyl-4-piperidyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCN(CC1)CCCCCC[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1(CCN(CC1)CCCCCC[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C19H28N2O4/c1-17(22)25-19(18-9-5-4-6-10-18)11-15-20(16-12-19)13-7-2-3-8-14-21(23)24/h4-6,9-10H,2-3,7-8,11-16H2,1H3