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[[(5S,7R)-3-nitrooxy-1-adamantyl]-phenyl-methyl] nitrate

[[(5S,7R)-3-nitrooxy-1-adamantyl]-phenyl-methyl] nitrate

Systemtic Name:[[(5S,7R)-3-nitrooxy-1-adamantyl]-phenyl-methyl] nitrate
Openeye Name:[[(5S,7R)-3-nitrooxy-1-adamantyl]-phenyl-methyl] nitrate
CAS Name:nitric acid [[(5S,7R)-3-nitrooxy-1-adamantyl]-phenylmethyl] ester
IUPAC Name:[[(5S,7R)-3-nitrooxy-1-adamantyl]-phenylmethyl] nitrate
Traditional Name:nitric acid [[(5S,7R)-3-nitrooxy-1-adamantyl]-phenyl-methyl] ester
Formula: C17H20N2O6
MolecularWeight: 348.3505
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O[N+](=O)[O-])C(C4=CC=CC=C4)O[N+](=O)[O-]


Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O[N+](=O)[O-])C(C4=CC=CC=C4)O[N+](=O)[O-]


InChI

InChI=1S/C17H20N2O6/c20-18(21)24-15(14-4-2-1-3-5-14)16-7-12-6-13(8-16)10-17(9-12,11-16)25-19(22)23/h1-5,12-13,15H,6-11H2/t12-,13+,15?,16?,17?


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