5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-(1-dimethylphosphorylbutyl)-2-nitro-aniline

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-(1-dimethylphosphorylbutyl)-2-nitro-aniline Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-(1-dimethylphosphorylbutyl)-2-nitro-aniline CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-(1-dimethylphosphorylbutyl)-2-nitroaniline IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-(1-dimethylphosphorylbutyl)-2-nitroaniline Traditional Name: [5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-(1-dimethylphosphorylbutyl)amine Formula: C19H21ClF3N2O4P MolecularWeight: 464.803011

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])P(=O)(C)C

Isomeric SMILES

CCCC(NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])P(=O)(C)C

InChI

InChI=1S/C19H21ClF3N2O4P/c1-4-5-18(30(2,3)28)24-15-11-13(7-8-16(15)25(26)27)29-17-9-6-12(10-14(17)20)19(21,22)23/h6-11,18,24H,4-5H2,1-3H3