1-(2-chloranyl-3,5-dinitro-phenyl)adamantane

Systemtic Name: 1-(2-chloranyl-3,5-dinitro-phenyl)adamantane Openeye Name: 1-(2-chloro-3,5-dinitro-phenyl)adamantane CAS Name: 1-(2-chloro-3,5-dinitrophenyl)adamantane IUPAC Name: 1-(2-chloro-3,5-dinitrophenyl)adamantane Traditional Name: 1-(2-chloro-3,5-dinitro-phenyl)adamantane Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=CC(=C4Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=CC(=C4Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O4/c17-15-13(4-12(18(20)21)5-14(15)19(22)23)16-6-9-1-10(7-16)3-11(2-9)8-16/h4-5,9-11H,1-3,6-8H2