4-[2,5-dicyclopentyl-4-[(4-nitrophenyl)methoxy]phenyl]sulfonylphenol

Systemtic Name: 4-[2,5-dicyclopentyl-4-[(4-nitrophenyl)methoxy]phenyl]sulfonylphenol Openeye Name: 4-[2,5-dicyclopentyl-4-[(4-nitrophenyl)methoxy]phenyl]sulfonylphenol CAS Name: 4-[2,5-dicyclopentyl-4-[(4-nitrophenyl)methoxy]phenyl]sulfonylphenol IUPAC Name: 4-[2,5-dicyclopentyl-4-[(4-nitrophenyl)methoxy]phenyl]sulfonylphenol Traditional Name: 4-[2,5-dicyclopentyl-4-(4-nitrobenzyl)oxy-phenyl]sulfonylphenol Formula: C29H31NO6S MolecularWeight: 521.62454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC(=C(C=C2S(=O)(=O)C3=CC=C(C=C3)O)C4CCCC4)OCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C2=CC(=C(C=C2S(=O)(=O)C3=CC=C(C=C3)O)C4CCCC4)OCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H31NO6S/c31-24-13-15-25(16-14-24)37(34,35)29-18-26(21-5-1-2-6-21)28(17-27(29)22-7-3-4-8-22)36-19-20-9-11-23(12-10-20)30(32)33/h9-18,21-22,31H,1-8,19H2