(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-oxidanyl-2-phenyl-propanoate; methyl nitrate

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-oxidanyl-2-phenyl-propanoate; methyl nitrate Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenyl-propanoate; methyl nitrate CAS Name: 3-hydroxy-2-phenylpropanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; nitric acid methyl ester IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate; methyl nitrate Traditional Name: 3-hydroxy-2-phenyl-propionic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; nitric acid methyl ester Formula: C18H26N2O6 MolecularWeight: 366.40884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CO[N+](=O)[O-]

Isomeric SMILES

CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CO[N+](=O)[O-]

InChI

InChI=1S/C17H23NO3.CH3NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5-2(3)4/h2-6,13-16,19H,7-11H2,1H3;1H3