dimethyl phosphate; (E)-4-[(3-nitrophenyl)methoxy]-4-oxidanyl-but-3-en-2-one

Systemtic Name: dimethyl phosphate; (E)-4-[(3-nitrophenyl)methoxy]-4-oxidanyl-but-3-en-2-one Openeye Name: dimethyl phosphate; (E)-4-hydroxy-4-[(3-nitrophenyl)methoxy]but-3-en-2-one CAS Name: dimethyl phosphate; (E)-4-hydroxy-4-[(3-nitrophenyl)methoxy]-3-buten-2-one IUPAC Name: dimethyl phosphate; (E)-4-hydroxy-4-[(3-nitrophenyl)methoxy]but-3-en-2-one Traditional Name: dimethyl phosphate; (E)-4-hydroxy-4-(3-nitrobenzyl)oxy-but-3-en-2-one Formula: C13H17NO9P- MolecularWeight: 362.249141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO5.C2H7O4P/c1-8(13)5-11(14)17-7-9-3-2-4-10(6-9)12(15)16;1-5-7(3,4)6-2/h2-6,14H,7H2,1H3;1-2H3,(H,3,4)/p-1/b11-5+;