(E)-2-oxidanyl-4-(phenylmethoxycarbonylamino)but-1-ene-1-diazonium

Systemtic Name: (E)-2-oxidanyl-4-(phenylmethoxycarbonylamino)but-1-ene-1-diazonium Openeye Name: (E)-4-(benzyloxycarbonylamino)-2-hydroxy-but-1-ene-1-diazonium CAS Name: (E)-2-hydroxy-4-(phenylmethoxycarbonylamino)-1-butene-1-diazonium IUPAC Name: (E)-2-hydroxy-4-(phenylmethoxycarbonylamino)but-1-ene-1-diazonium Traditional Name: (E)-4-(benzyloxycarbonylamino)-2-hydroxy-but-1-ene-1-diazonium Formula: C12H14N3O3+ MolecularWeight: 248.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC(=C[N+]#N)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC/C(=C\[N+]#N)/O

InChI

InChI=1S/C12H13N3O3/c13-15-8-11(16)6-7-14-12(17)18-9-10-4-2-1-3-5-10/h1-5,8H,6-7,9H2,(H-,14,16,17)/p+1/b11-8+