(Z)-1-diazonio-6-methoxy-6-oxidanylidene-5-(phenylmethoxycarbonylamino)hex-1-en-2-olate

Systemtic Name: (Z)-1-diazonio-6-methoxy-6-oxidanylidene-5-(phenylmethoxycarbonylamino)hex-1-en-2-olate Openeye Name: (Z)-5-(benzyloxycarbonylamino)-1-diazonio-6-methoxy-6-oxo-hex-1-en-2-olate CAS Name: (Z)-1-diazonio-6-methoxy-6-oxo-5-(phenylmethoxycarbonylamino)-1-hexen-2-olate IUPAC Name: (Z)-1-diazonio-6-methoxy-6-oxo-5-(phenylmethoxycarbonylamino)hex-1-en-2-olate Traditional Name: (Z)-5-(benzyloxycarbonylamino)-1-diazonio-6-keto-6-methoxy-hex-1-en-2-olate Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=C[N+]#N)[O-])NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(CC/C(=C/[N+]#N)/[O-])NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H17N3O5/c1-22-14(20)13(8-7-12(19)9-17-16)18-15(21)23-10-11-5-3-2-4-6-11/h2-6,9,13H,7-8,10H2,1H3,(H-,18,19,21)/b12-9-