N-[di(propan-2-yloxy)phosphoryl-(2-fluorophenyl)methyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[di(propan-2-yloxy)phosphoryl-(2-fluorophenyl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[diisopropoxyphosphoryl-(2-fluorophenyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[di(propan-2-yloxy)phosphoryl-(2-fluorophenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[di(propan-2-yloxy)phosphoryl-(2-fluorophenyl)methyl]-4-methyl-3-nitroaniline Traditional Name: [diisopropoxyphosphoryl-(2-fluorophenyl)methyl]-(4-methyl-3-nitro-phenyl)amine Formula: C20H26FN2O5P MolecularWeight: 424.403004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C2=CC=CC=C2F)P(=O)(OC(C)C)OC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(C2=CC=CC=C2F)P(=O)(OC(C)C)OC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H26FN2O5P/c1-13(2)27-29(26,28-14(3)4)20(17-8-6-7-9-18(17)21)22-16-11-10-15(5)19(12-16)23(24)25/h6-14,20,22H,1-5H3