8-azabicyclo[3.2.1]octan-6-yl 4-nitrobenzoate

Systemtic Name: 8-azabicyclo[3.2.1]octan-6-yl 4-nitrobenzoate Openeye Name: 8-azabicyclo[3.2.1]octan-6-yl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 8-azabicyclo[3.2.1]octan-6-yl ester IUPAC Name: 8-azabicyclo[3.2.1]octan-6-yl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 8-azabicyclo[3.2.1]octan-6-yl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(C(C1)N2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC2CC(C(C1)N2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O4/c17-14(9-4-6-11(7-5-9)16(18)19)20-13-8-10-2-1-3-12(13)15-10/h4-7,10,12-13,15H,1-3,8H2