(E)-3-dimethoxyphosphoryl-N,N-diethyl-4-(4-nitrophenyl)-2-oxidanylidene-but-3-enamide

Systemtic Name: (E)-3-dimethoxyphosphoryl-N,N-diethyl-4-(4-nitrophenyl)-2-oxidanylidene-but-3-enamide Openeye Name: (E)-3-dimethoxyphosphoryl-N,N-diethyl-4-(4-nitrophenyl)-2-oxo-but-3-enamide CAS Name: (E)-3-dimethoxyphosphoryl-N,N-diethyl-4-(4-nitrophenyl)-2-oxo-3-butenamide IUPAC Name: (E)-3-dimethoxyphosphoryl-N,N-diethyl-4-(4-nitrophenyl)-2-oxobut-3-enamide Traditional Name: (E)-3-dimethoxyphosphoryl-N,N-diethyl-2-keto-4-(4-nitrophenyl)but-3-enamide Formula: C16H21N2O7P MolecularWeight: 384.320901

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])P(=O)(OC)OC

Isomeric SMILES

CCN(CC)C(=O)C(=O)/C(=C\C1=CC=C(C=C1)[N+](=O)[O-])/P(=O)(OC)OC

InChI

InChI=1S/C16H21N2O7P/c1-5-17(6-2)16(20)15(19)14(26(23,24-3)25-4)11-12-7-9-13(10-8-12)18(21)22/h7-11H,5-6H2,1-4H3/b14-11+