(Z,3R)-1-diazonio-4-(4-hydroxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]but-1-en-2-olate

Systemtic Name: (Z,3R)-1-diazonio-4-(4-hydroxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]but-1-en-2-olate Openeye Name: (Z,3R)-3-(tert-butoxycarbonylamino)-1-diazonio-4-(4-hydroxyphenyl)but-1-en-2-olate CAS Name: (Z,3R)-1-diazonio-4-(4-hydroxyphenyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-buten-2-olate IUPAC Name: (Z,3R)-1-diazonio-4-(4-hydroxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]but-1-en-2-olate Traditional Name: (Z,3R)-3-(tert-butoxycarbonylamino)-1-diazonio-4-(4-hydroxyphenyl)but-1-en-2-olate Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=C[N+]#N)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)O)/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C15H19N3O4/c1-15(2,3)22-14(21)18-12(13(20)9-17-16)8-10-4-6-11(19)7-5-10/h4-7,9,12H,8H2,1-3H3,(H2-,18,19,20,21)/b13-9-/t12-/m1/s1