8-[3-chloranyl-2-(hydroxymethyl)-4-nitro-phenyl]-8-azabicyclo[3.2.1]octan-3-ol

Systemtic Name: 8-[3-chloranyl-2-(hydroxymethyl)-4-nitro-phenyl]-8-azabicyclo[3.2.1]octan-3-ol Openeye Name: 8-[3-chloro-2-(hydroxymethyl)-4-nitro-phenyl]-8-azabicyclo[3.2.1]octan-3-ol CAS Name: 8-[3-chloro-2-(hydroxymethyl)-4-nitrophenyl]-8-azabicyclo[3.2.1]octan-3-ol IUPAC Name: 8-[3-chloro-2-(hydroxymethyl)-4-nitrophenyl]-8-azabicyclo[3.2.1]octan-3-ol Traditional Name: 8-(3-chloro-2-methylol-4-nitro-phenyl)-8-azabicyclo[3.2.1]octan-3-ol Formula: C14H17ClN2O4 MolecularWeight: 312.74878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C3=C(C(=C(C=C3)[N+](=O)[O-])Cl)CO)O

Isomeric SMILES

C1CC2CC(CC1N2C3=C(C(=C(C=C3)[N+](=O)[O-])Cl)CO)O

InChI

InChI=1S/C14H17ClN2O4/c15-14-11(7-18)12(3-4-13(14)17(20)21)16-8-1-2-9(16)6-10(19)5-8/h3-4,8-10,18-19H,1-2,5-7H2