6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl 4-nitrobenzoate

Systemtic Name: 6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl 4-nitrobenzoate Openeye Name: 6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl ester IUPAC Name: 6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 6-bicyclo[9.2.2]pentadeca-1(13),11,14-trienyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=CC=C(CCCCC(C1)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C=C2

Isomeric SMILES

C1CCC2=CC=C(CCCCC(C1)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C=C2

InChI

InChI=1S/C22H25NO4/c24-22(19-13-15-20(16-14-19)23(25)26)27-21-7-3-1-5-17-9-11-18(12-10-17)6-2-4-8-21/h9-16,21H,1-8H2