1-[5-isocyano-2-[4-(trifluoromethyloxy)phenoxy]phenyl]-N-methyl-methanamine

Systemtic Name: 1-[5-isocyano-2-[4-(trifluoromethyloxy)phenoxy]phenyl]-N-methyl-methanamine Openeye Name: 1-[5-isocyano-2-[4-(trifluoromethoxy)phenoxy]phenyl]-N-methyl-methanamine CAS Name: 1-[5-isocyano-2-[4-(trifluoromethoxy)phenoxy]phenyl]-N-methylmethanamine IUPAC Name: 1-[5-isocyano-2-[4-(trifluoromethoxy)phenoxy]phenyl]-N-methylmethanamine Traditional Name: [5-isocyano-2-[4-(trifluoromethoxy)phenoxy]benzyl]-methyl-amine Formula: C16H13F3N2O2 MolecularWeight: 322.28183

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)[N+]#[C-])OC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CNCC1=C(C=CC(=C1)[N+]#[C-])OC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C16H13F3N2O2/c1-20-10-11-9-12(21-2)3-8-15(11)22-13-4-6-14(7-5-13)23-16(17,18)19/h3-9,20H,10H2,1H3