(3-nitro-4-phenoxy-phenyl)methyl N-[3-(trifluoromethyl)phenyl]carbamate

Systemtic Name: (3-nitro-4-phenoxy-phenyl)methyl N-[3-(trifluoromethyl)phenyl]carbamate Openeye Name: (3-nitro-4-phenoxy-phenyl)methyl N-[3-(trifluoromethyl)phenyl]carbamate CAS Name: N-[3-(trifluoromethyl)phenyl]carbamic acid (3-nitro-4-phenoxyphenyl)methyl ester IUPAC Name: (3-nitro-4-phenoxyphenyl)methyl N-[3-(trifluoromethyl)phenyl]carbamate Traditional Name: N-[3-(trifluoromethyl)phenyl]carbamic acid (3-nitro-4-phenoxy-benzyl) ester Formula: C21H15F3N2O5 MolecularWeight: 432.34941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2)COC(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2)COC(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H15F3N2O5/c22-21(23,24)15-5-4-6-16(12-15)25-20(27)30-13-14-9-10-19(18(11-14)26(28)29)31-17-7-2-1-3-8-17/h1-12H,13H2,(H,25,27)