(1Z)-2-diazonio-1-[[5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methoxy]buta-1,3-dien-1-olate

Systemtic Name: (1Z)-2-diazonio-1-[[5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methoxy]buta-1,3-dien-1-olate Openeye Name: (1Z)-1-[(1-tert-butoxycarbonyl-5-methyl-pyrrol-2-yl)methoxy]-2-diazonio-buta-1,3-dien-1-olate CAS Name: (1Z)-2-diazonio-1-[[5-methyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolyl]methoxy]-1-buta-1,3-dienolate IUPAC Name: (1Z)-2-diazonio-1-[[5-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methoxy]buta-1,3-dien-1-olate Traditional Name: (1Z)-1-[(1-tert-butoxycarbonyl-5-methyl-pyrrol-2-yl)methoxy]-2-diazonio-buta-1,3-dien-1-olate Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C(=O)OC(C)(C)C)COC(=C(C=C)[N+]#N)[O-]

Isomeric SMILES

CC1=CC=C(N1C(=O)OC(C)(C)C)CO/C(=C(/C=C)\[N+]#N)/[O-]

InChI

InChI=1S/C15H19N3O4/c1-6-12(17-16)13(19)21-9-11-8-7-10(2)18(11)14(20)22-15(3,4)5/h6-8H,1,9H2,2-5H3/b13-12-