(Z,5R)-2-diazonio-1-methoxy-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-1-en-1-olate

Systemtic Name: (Z,5R)-2-diazonio-1-methoxy-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-1-en-1-olate Openeye Name: (Z,5R)-5-(tert-butoxycarbonylamino)-2-diazonio-1-methoxy-6,6-dimethyl-hept-1-en-1-olate CAS Name: (Z,5R)-2-diazonio-1-methoxy-6,6-dimethyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-hepten-1-olate IUPAC Name: (Z,5R)-2-diazonio-1-methoxy-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-1-en-1-olate Traditional Name: (Z,5R)-5-(tert-butoxycarbonylamino)-2-diazonio-1-methoxy-6,6-dimethyl-hept-1-en-1-olate Formula: C15H27N3O4 MolecularWeight: 313.39258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H27N3O4/c1-14(2,3)11(17-13(20)22-15(4,5)6)9-8-10(18-16)12(19)21-7/h11H,8-9H2,1-7H3,(H-,17,19,20)/b12-10-/t11-/m1/s1