(Z,5R)-2-diazonio-5-(4-fluorophenyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1-prop-2-enoxy-pent-1-en-1-olate

Systemtic Name: (Z,5R)-2-diazonio-5-(4-fluorophenyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1-prop-2-enoxy-pent-1-en-1-olate Openeye Name: (Z,5R)-1-allyloxy-5-(tert-butoxycarbonylamino)-2-diazonio-5-(4-fluorophenyl)-3-oxo-pent-1-en-1-olate CAS Name: (Z,5R)-2-diazonio-5-(4-fluorophenyl)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-1-prop-2-enoxy-1-penten-1-olate IUPAC Name: (Z,5R)-2-diazonio-5-(4-fluorophenyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-1-prop-2-enoxypent-1-en-1-olate Traditional Name: (Z,5R)-1-allyloxy-5-(tert-butoxycarbonylamino)-2-diazonio-5-(4-fluorophenyl)-3-keto-pent-1-en-1-olate Formula: C19H22FN3O5 MolecularWeight: 391.393483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)C(=C([O-])OCC=C)[N+]#N)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC(=O)/C(=C(\[O-])/OCC=C)/[N+]#N)C1=CC=C(C=C1)F

InChI

InChI=1S/C19H22FN3O5/c1-5-10-27-17(25)16(23-21)15(24)11-14(12-6-8-13(20)9-7-12)22-18(26)28-19(2,3)4/h5-9,14H,1,10-11H2,2-4H3,(H-,22,24,25,26)/t14-/m1/s1