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

Systemtic Name: ethyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate Openeye Name: ethyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate CAS Name: 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate Traditional Name: 4-[[diethoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid ethyl ester Formula: C20H25N2O7P MolecularWeight: 436.395461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC(=CC=C2)[N+](=O)[O-])P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC(=CC=C2)[N+](=O)[O-])P(=O)(OCC)OCC

InChI

InChI=1S/C20H25N2O7P/c1-4-27-20(23)15-10-12-17(13-11-15)21-19(30(26,28-5-2)29-6-3)16-8-7-9-18(14-16)22(24)25/h7-14,19,21H,4-6H2,1-3H3