(methoxycarbonylamino) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzenecarboperoxoate

Systemtic Name: (methoxycarbonylamino) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzenecarboperoxoate Openeye Name: (methoxycarbonylamino) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzenecarboperoxoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzenecarboperoxoic acid (methoxycarbonylamino) ester IUPAC Name: (methoxycarbonylamino) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzenecarboperoxoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzenecarboperoxoic acid (carbomethoxyamino) ester Formula: C16H10ClF3N2O8 MolecularWeight: 450.70741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClF3N2O8/c1-27-15(24)21-30-29-14(23)10-7-9(3-4-12(10)22(25)26)28-13-5-2-8(6-11(13)17)16(18,19)20/h2-7H,1H3,(H,21,24)