[5-(2-phenylpropan-2-yl)oxolan-3-yl] nitrate

Systemtic Name: [5-(2-phenylpropan-2-yl)oxolan-3-yl] nitrate Openeye Name: [5-(1-methyl-1-phenyl-ethyl)tetrahydrofuran-3-yl] nitrate CAS Name: nitric acid [5-(2-phenylpropan-2-yl)-3-oxolanyl] ester IUPAC Name: [5-(2-phenylpropan-2-yl)oxolan-3-yl] nitrate Traditional Name: nitric acid (5-cumyltetrahydrofuran-3-yl) ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC(CO1)O[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC(C)(C1CC(CO1)O[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C13H17NO4/c1-13(2,10-6-4-3-5-7-10)12-8-11(9-17-12)18-14(15)16/h3-7,11-12H,8-9H2,1-2H3