N-[2-nitro-4-(trifluoromethyl)phenyl]adamantan-2-amine

Systemtic Name: N-[2-nitro-4-(trifluoromethyl)phenyl]adamantan-2-amine Openeye Name: N-[2-nitro-4-(trifluoromethyl)phenyl]adamantan-2-amine CAS Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-adamantanamine IUPAC Name: N-[2-nitro-4-(trifluoromethyl)phenyl]adamantan-2-amine Traditional Name: 2-adamantyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C17H19F3N2O2 MolecularWeight: 340.34017

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H19F3N2O2/c18-17(19,20)13-1-2-14(15(8-13)22(23)24)21-16-11-4-9-3-10(6-11)7-12(16)5-9/h1-2,8-12,16,21H,3-7H2