prop-2-enyl 4-[[dimethylamino-[(5-nitrofuran-2-yl)methoxy]phosphoryl]amino]benzoate

Systemtic Name: prop-2-enyl 4-[[dimethylamino-[(5-nitrofuran-2-yl)methoxy]phosphoryl]amino]benzoate Openeye Name: allyl 4-[[dimethylamino-[(5-nitro-2-furyl)methoxy]phosphoryl]amino]benzoate CAS Name: 4-[[dimethylamino-[(5-nitro-2-furanyl)methoxy]phosphoryl]amino]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[[dimethylamino-[(5-nitrofuran-2-yl)methoxy]phosphoryl]amino]benzoate Traditional Name: 4-[[dimethylamino-[(5-nitro-2-furyl)methoxy]phosphoryl]amino]benzoic acid allyl ester Formula: C17H20N3O7P MolecularWeight: 409.330361

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)P(=O)(NC1=CC=C(C=C1)C(=O)OCC=C)OCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CN(C)P(=O)(NC1=CC=C(C=C1)C(=O)OCC=C)OCC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N3O7P/c1-4-11-25-17(21)13-5-7-14(8-6-13)18-28(24,19(2)3)26-12-15-9-10-16(27-15)20(22)23/h4-10H,1,11-12H2,2-3H3,(H,18,24)