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

Systemtic Name: (Z,3S)-1-diazonio-4-methyl-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Openeye Name: (Z,3S)-3-(benzyloxycarbonylamino)-1-diazonio-4-methyl-pent-1-en-2-olate CAS Name: (Z,3S)-1-diazonio-4-methyl-3-(phenylmethoxycarbonylamino)-1-penten-2-olate IUPAC Name: (Z,3S)-1-diazonio-4-methyl-3-(phenylmethoxycarbonylamino)pent-1-en-2-olate Traditional Name: (Z,3S)-3-(benzyloxycarbonylamino)-1-diazonio-4-methyl-pent-1-en-2-olate Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3/c1-10(2)13(12(18)8-16-15)17-14(19)20-9-11-6-4-3-5-7-11/h3-8,10,13H,9H2,1-2H3,(H-,17,18,19)/b12-8-/t13-/m0/s1