(Z)-2-diazonio-1-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-3-yl]methoxy]-3-oxidanyl-but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-3-yl]methoxy]-3-oxidanyl-but-1-en-1-olate Openeye Name: (Z)-1-[(1-tert-butoxycarbonylpyrrol-3-yl)methoxy]-2-diazonio-3-hydroxy-but-1-en-1-olate CAS Name: (Z)-2-diazonio-3-hydroxy-1-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolyl]methoxy]-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-3-hydroxy-1-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-3-yl]methoxy]but-1-en-1-olate Traditional Name: (Z)-1-[(1-tert-butoxycarbonylpyrrol-3-yl)methoxy]-2-diazonio-3-hydroxy-but-1-en-1-olate Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(/C(=C(\[O-])/OCC1=CN(C=C1)C(=O)OC(C)(C)C)/[N+]#N)O

InChI

InChI=1S/C14H19N3O5/c1-9(18)11(16-15)12(19)21-8-10-5-6-17(7-10)13(20)22-14(2,3)4/h5-7,9,18H,8H2,1-4H3/b12-11-