(Z,3R)-1-diazonio-3-[(R)-phenyl(phenylmethoxycarbonylamino)methyl]pent-1-en-2-olate

Systemtic Name: (Z,3R)-1-diazonio-3-[(R)-phenyl(phenylmethoxycarbonylamino)methyl]pent-1-en-2-olate Openeye Name: (Z,3R)-3-[(R)-benzyloxycarbonylamino(phenyl)methyl]-1-diazonio-pent-1-en-2-olate CAS Name: (Z,3R)-1-diazonio-3-[(R)-phenyl(phenylmethoxycarbonylamino)methyl]-1-penten-2-olate IUPAC Name: (Z,3R)-1-diazonio-3-[(R)-phenyl(phenylmethoxycarbonylamino)methyl]pent-1-en-2-olate Traditional Name: (Z,3R)-3-[(R)-benzyloxycarbonylamino(phenyl)methyl]-1-diazonio-pent-1-en-2-olate Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(=C[N+]#N)[O-]

Isomeric SMILES

CC[C@H]([C@H](C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C20H21N3O3/c1-2-17(18(24)13-22-21)19(16-11-7-4-8-12-16)23-20(25)26-14-15-9-5-3-6-10-15/h3-13,17,19H,2,14H2,1H3,(H-,23,24,25)/b18-13-/t17-,19-/m0/s1