(E)-1-ethoxy-3-[2-fluoranyl-5-(morpholin-4-ylmethyl)phenyl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium

Systemtic Name: (E)-1-ethoxy-3-[2-fluoranyl-5-(morpholin-4-ylmethyl)phenyl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium Openeye Name: (E)-1-ethoxy-3-[2-fluoro-5-(morpholinomethyl)phenyl]-1-hydroxy-3-oxo-prop-1-ene-2-diazonium CAS Name: (E)-1-ethoxy-3-[2-fluoro-5-(4-morpholinylmethyl)phenyl]-1-hydroxy-3-oxo-1-propene-2-diazonium IUPAC Name: (E)-1-ethoxy-3-[2-fluoro-5-(morpholin-4-ylmethyl)phenyl]-1-hydroxy-3-oxoprop-1-ene-2-diazonium Traditional Name: (E)-1-ethoxy-3-[2-fluoro-5-(morpholinomethyl)phenyl]-1-hydroxy-3-keto-prop-1-ene-2-diazonium Formula: C16H19FN3O4+ MolecularWeight: 336.338163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C1=C(C=CC(=C1)CN2CCOCC2)F)[N+]#N)O

Isomeric SMILES

CCO/C(=C(\C(=O)C1=C(C=CC(=C1)CN2CCOCC2)F)/[N+]#N)/O

InChI

InChI=1S/C16H18FN3O4/c1-2-24-16(22)14(19-18)15(21)12-9-11(3-4-13(12)17)10-20-5-7-23-8-6-20/h3-4,9H,2,5-8,10H2,1H3/p+1