(Z,3S)-1-diazonio-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate

Systemtic Name: (Z,3S)-1-diazonio-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Openeye Name: (Z,3S)-3-(benzyloxycarbonylamino)-5-tert-butoxy-1-diazonio-5-oxo-pent-1-en-2-olate CAS Name: (Z,3S)-1-diazonio-5-[(2-methylpropan-2-yl)oxy]-5-oxo-3-(phenylmethoxycarbonylamino)-1-penten-2-olate IUPAC Name: (Z,3S)-1-diazonio-5-[(2-methylpropan-2-yl)oxy]-5-oxo-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Traditional Name: (Z,3S)-3-(benzyloxycarbonylamino)-5-tert-butoxy-1-diazonio-5-keto-pent-1-en-2-olate Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](/C(=C/[N+]#N)/[O-])NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H21N3O5/c1-17(2,3)25-15(22)9-13(14(21)10-19-18)20-16(23)24-11-12-7-5-4-6-8-12/h4-8,10,13H,9,11H2,1-3H3,(H-,20,21,23)/b14-10-/t13-/m0/s1