N-[2-(1-adamantyloxy)ethyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[2-(1-adamantyloxy)ethyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[2-(1-adamantyloxy)ethyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[2-(1-adamantyloxy)ethyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[2-(1-adamantyloxy)ethyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: 2-(1-adamantyloxy)ethyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C19H23F3N2O3 MolecularWeight: 384.39273

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OCCNC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OCCNC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H23F3N2O3/c20-19(21,22)15-1-2-16(17(8-15)24(25)26)23-3-4-27-18-9-12-5-13(10-18)7-14(6-12)11-18/h1-2,8,12-14,23H,3-7,9-11H2