5-chloranyl-2-nitro-4-(trifluoromethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]aniline

Systemtic Name: 5-chloranyl-2-nitro-4-(trifluoromethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]aniline Openeye Name: 5-chloro-2-nitro-4-(trifluoromethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]aniline CAS Name: 5-chloro-2-nitro-4-(trifluoromethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]aniline IUPAC Name: 5-chloro-2-nitro-4-(trifluoromethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]aniline Traditional Name: [5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-(2,4,5-trimethoxybenzyl)amine Formula: C17H16ClF3N2O5 MolecularWeight: 420.76755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H16ClF3N2O5/c1-26-14-7-16(28-3)15(27-2)4-9(14)8-22-12-6-11(18)10(17(19,20)21)5-13(12)23(24)25/h4-7,22H,8H2,1-3H3