7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl 3,5-dinitrobenzoate

Systemtic Name: 7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl 3,5-dinitrobenzoate Openeye Name: 7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl ester IUPAC Name: 7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 7-bicyclo[10.2.2]hexadeca-1(14),12,15-trienyl ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CCCCC2=CC=C(CC1)C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CCCCC2=CC=C(CC1)C=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H26N2O6/c26-23(19-14-20(24(27)28)16-21(15-19)25(29)30)31-22-8-3-1-2-6-17-10-12-18(13-11-17)7-4-5-9-22/h10-16,22H,1-9H2