methyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate

Systemtic Name: methyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate Openeye Name: methyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate CAS Name: 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate Traditional Name: 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid methyl ester Formula: C19H23N2O7P MolecularWeight: 422.368881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N2O7P/c1-4-27-29(25,28-5-2)18(15-7-6-8-17(13-15)21(23)24)20-16-11-9-14(10-12-16)19(22)26-3/h6-13,18,20H,4-5H2,1-3H3