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4-(1-adamantyl)-2,6-dinitro-phenol

4-(1-adamantyl)-2,6-dinitro-phenol

Systemtic Name:4-(1-adamantyl)-2,6-dinitro-phenol
Openeye Name:4-(1-adamantyl)-2,6-dinitro-phenol
CAS Name:4-(1-adamantyl)-2,6-dinitrophenol
IUPAC Name:4-(1-adamantyl)-2,6-dinitrophenol
Traditional Name:4-(1-adamantyl)-2,6-dinitro-phenol
Formula: C16H18N2O5
MolecularWeight: 318.32452
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C(=C4)[N+](=O)[O-])O)[N+](=O)[O-]


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C(=C4)[N+](=O)[O-])O)[N+](=O)[O-]


InChI

InChI=1S/C16H18N2O5/c19-15-13(17(20)21)4-12(5-14(15)18(22)23)16-6-9-1-10(7-16)3-11(2-9)8-16/h4-5,9-11,19H,1-3,6-8H2


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