[(1S,2S)-2-oxidanylcyclooctyl] 4-nitrobenzoate

Systemtic Name: [(1S,2S)-2-oxidanylcyclooctyl] 4-nitrobenzoate Openeye Name: [(1S,2S)-2-hydroxycyclooctyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1S,2S)-2-hydroxycyclooctyl] ester IUPAC Name: [(1S,2S)-2-hydroxycyclooctyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S,2S)-2-hydroxycyclooctyl] ester Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(C(CC1)O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC[C@@H]([C@H](CC1)O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19NO5/c17-13-5-3-1-2-4-6-14(13)21-15(18)11-7-9-12(10-8-11)16(19)20/h7-10,13-14,17H,1-6H2/t13-,14-/m0/s1