(E)-3-(carboxyamino)-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-oxidanyl-but-1-ene-1-diazonium

Systemtic Name: (E)-3-(carboxyamino)-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-oxidanyl-but-1-ene-1-diazonium Openeye Name: (E)-4-(4-tert-butoxyphenyl)-3-(carboxyamino)-2-hydroxy-but-1-ene-1-diazonium CAS Name: (E)-3-(carboxyamino)-2-hydroxy-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1-butene-1-diazonium IUPAC Name: (E)-3-(carboxyamino)-2-hydroxy-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]but-1-ene-1-diazonium Traditional Name: (E)-4-(4-tert-butoxyphenyl)-3-(carboxyamino)-2-hydroxy-but-1-ene-1-diazonium Formula: C15H20N3O4+ MolecularWeight: 306.337

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)CC(C(=C[N+]#N)O)NC(=O)O

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)CC(/C(=C\[N+]#N)/O)NC(=O)O

InChI

InChI=1S/C15H19N3O4/c1-15(2,3)22-11-6-4-10(5-7-11)8-12(18-14(20)21)13(19)9-17-16/h4-7,9,12,18H,8H2,1-3H3,(H-,19,20,21)/p+1/b13-9+