N-[(2,4-dimethoxyphenyl)-dimethoxyphosphoryl-methyl]-4-nitro-aniline

Systemtic Name: N-[(2,4-dimethoxyphenyl)-dimethoxyphosphoryl-methyl]-4-nitro-aniline Openeye Name: N-[(2,4-dimethoxyphenyl)-dimethoxyphosphoryl-methyl]-4-nitro-aniline CAS Name: N-[(2,4-dimethoxyphenyl)-dimethoxyphosphorylmethyl]-4-nitroaniline IUPAC Name: N-[(2,4-dimethoxyphenyl)-dimethoxyphosphorylmethyl]-4-nitroaniline Traditional Name: [(2,4-dimethoxyphenyl)-dimethoxyphosphoryl-methyl]-(4-nitrophenyl)amine Formula: C17H21N2O7P MolecularWeight: 396.331601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(NC2=CC=C(C=C2)[N+](=O)[O-])P(=O)(OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(NC2=CC=C(C=C2)[N+](=O)[O-])P(=O)(OC)OC)OC

InChI

InChI=1S/C17H21N2O7P/c1-23-14-9-10-15(16(11-14)24-2)17(27(22,25-3)26-4)18-12-5-7-13(8-6-12)19(20)21/h5-11,17-18H,1-4H3