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

Systemtic Name: (Z)-2-diazonio-1-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]ethoxy]-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-1-[2-(1-tert-butoxycarbonylpyrrol-2-yl)ethoxy]-2-diazonio-3-oxo-but-1-en-1-olate CAS Name: (Z)-2-diazonio-1-[2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolyl]ethoxy]-3-oxo-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-1-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]ethoxy]-3-oxobut-1-en-1-olate Traditional Name: (Z)-1-[2-(1-tert-butoxycarbonylpyrrol-2-yl)ethoxy]-2-diazonio-3-keto-but-1-en-1-olate Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C([O-])OCCC1=CC=CN1C(=O)OC(C)(C)C)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\[O-])/OCCC1=CC=CN1C(=O)OC(C)(C)C)/[N+]#N

InChI

InChI=1S/C15H19N3O5/c1-10(19)12(17-16)13(20)22-9-7-11-6-5-8-18(11)14(21)23-15(2,3)4/h5-6,8H,7,9H2,1-4H3