(Z,5S)-6-ethoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-6-oxidanylidene-hex-1-ene-1-diazonium

Systemtic Name: (Z,5S)-6-ethoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-6-oxidanylidene-hex-1-ene-1-diazonium Openeye Name: (Z,5S)-5-(tert-butoxycarbonylamino)-6-ethoxy-2-hydroxy-6-oxo-hex-1-ene-1-diazonium CAS Name: (Z,5S)-6-ethoxy-2-hydroxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-1-hexene-1-diazonium IUPAC Name: (Z,5S)-6-ethoxy-2-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohex-1-ene-1-diazonium Traditional Name: (Z,5S)-5-(tert-butoxycarbonylamino)-6-ethoxy-2-hydroxy-6-keto-hex-1-ene-1-diazonium Formula: C13H22N3O5+ MolecularWeight: 300.33088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=C[N+]#N)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC/C(=C/[N+]#N)/O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H21N3O5/c1-5-20-11(18)10(7-6-9(17)8-15-14)16-12(19)21-13(2,3)4/h8,10H,5-7H2,1-4H3,(H-,16,17,19)/p+1/b9-8-/t10-/m0/s1