(Z,3S)-1-diazonio-4,4-dimethyl-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate

Systemtic Name: (Z,3S)-1-diazonio-4,4-dimethyl-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Openeye Name: (Z,3S)-3-(benzyloxycarbonylamino)-1-diazonio-4,4-dimethyl-pent-1-en-2-olate CAS Name: (Z,3S)-1-diazonio-4,4-dimethyl-3-(phenylmethoxycarbonylamino)-1-penten-2-olate IUPAC Name: (Z,3S)-1-diazonio-4,4-dimethyl-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Traditional Name: (Z,3S)-3-(benzyloxycarbonylamino)-1-diazonio-4,4-dimethyl-pent-1-en-2-olate Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O3/c1-15(2,3)13(12(19)9-17-16)18-14(20)21-10-11-7-5-4-6-8-11/h4-9,13H,10H2,1-3H3,(H-,18,19,20)/b12-9-/t13-/m1/s1