N-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[diethoxyphosphoryl-(4-fluorophenyl)methyl]-4-methyl-3-nitroaniline Traditional Name: [diethoxyphosphoryl-(4-fluorophenyl)methyl]-(4-methyl-3-nitro-phenyl)amine Formula: C18H22FN2O5P MolecularWeight: 396.349844

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=C(C=C1)F)NC2=CC(=C(C=C2)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=C(C=C1)F)NC2=CC(=C(C=C2)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C18H22FN2O5P/c1-4-25-27(24,26-5-2)18(14-7-9-15(19)10-8-14)20-16-11-6-13(3)17(12-16)21(22)23/h6-12,18,20H,4-5H2,1-3H3