(Z)-2-diazonio-1-[(2S,4R)-4-phenylmethoxy-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]ethenolate

Systemtic Name: (Z)-2-diazonio-1-[(2S,4R)-4-phenylmethoxy-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]ethenolate Openeye Name: (Z)-1-[(2S,4R)-4-benzyloxy-1-benzyloxycarbonyl-pyrrolidin-2-yl]-2-diazonio-ethenolate CAS Name: (Z)-2-diazonio-1-[(2S,4R)-4-phenylmethoxy-1-phenylmethoxycarbonyl-2-pyrrolidinyl]ethenolate IUPAC Name: (Z)-2-diazonio-1-[(2S,4R)-4-phenylmethoxy-1-phenylmethoxycarbonylpyrrolidin-2-yl]ethenolate Traditional Name: (Z)-1-[(2S,4R)-4-benzoxy-1-carbobenzoxy-pyrrolidin-2-yl]-2-diazonio-ethenolate Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=C[N+]#N)[O-])C(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1[C@H](CN([C@@H]1/C(=C/[N+]#N)/[O-])C(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c22-23-12-20(25)19-11-18(27-14-16-7-3-1-4-8-16)13-24(19)21(26)28-15-17-9-5-2-6-10-17/h1-10,12,18-19H,11,13-15H2/b20-12-/t18-,19+/m1/s1