[(1R,2S)-1-(9H-fluoren-9-yl)-2-methyl-cyclopentyl] 3,5-dinitrobenzoate

Systemtic Name: [(1R,2S)-1-(9H-fluoren-9-yl)-2-methyl-cyclopentyl] 3,5-dinitrobenzoate Openeye Name: [(1R,2S)-1-(9H-fluoren-9-yl)-2-methyl-cyclopentyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(1R,2S)-1-(9H-fluoren-9-yl)-2-methylcyclopentyl] ester IUPAC Name: [(1R,2S)-1-(9H-fluoren-9-yl)-2-methylcyclopentyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(1R,2S)-1-(9H-fluoren-9-yl)-2-methyl-cyclopentyl] ester Formula: C26H22N2O6 MolecularWeight: 458.46268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC1(C2C3=CC=CC=C3C4=CC=CC=C24)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@]1(C2C3=CC=CC=C3C4=CC=CC=C24)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H22N2O6/c1-16-7-6-12-26(16,24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24)34-25(29)17-13-18(27(30)31)15-19(14-17)28(32)33/h2-5,8-11,13-16,24H,6-7,12H2,1H3/t16-,26+/m0/s1