(4-nitrophenyl)methyl 2-dimethoxyphosphoryloxybut-3-enoate

Systemtic Name: (4-nitrophenyl)methyl 2-dimethoxyphosphoryloxybut-3-enoate Openeye Name: (4-nitrophenyl)methyl 2-dimethoxyphosphoryloxybut-3-enoate CAS Name: 2-dimethoxyphosphoryloxy-3-butenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-dimethoxyphosphoryloxybut-3-enoate Traditional Name: 2-dimethoxyphosphoryloxybut-3-enoic acid (4-nitrobenzyl) ester Formula: C13H16NO8P MolecularWeight: 345.241801

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(OC)OC(C=C)C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COP(=O)(OC)OC(C=C)C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H16NO8P/c1-4-12(22-23(18,19-2)20-3)13(15)21-9-10-5-7-11(8-6-10)14(16)17/h4-8,12H,1,9H2,2-3H3