(E)-1-diazonio-3-oxidanylidene-5-phenyl-4-(phenylmethoxycarbonylamino)pent-1-en-2-olate

Systemtic Name: (E)-1-diazonio-3-oxidanylidene-5-phenyl-4-(phenylmethoxycarbonylamino)pent-1-en-2-olate Openeye Name: (E)-4-(benzyloxycarbonylamino)-1-diazonio-3-oxo-5-phenyl-pent-1-en-2-olate CAS Name: (E)-1-diazonio-3-oxo-5-phenyl-4-(phenylmethoxycarbonylamino)-1-penten-2-olate IUPAC Name: (E)-1-diazonio-3-oxo-5-phenyl-4-(phenylmethoxycarbonylamino)pent-1-en-2-olate Traditional Name: (E)-4-(benzyloxycarbonylamino)-1-diazonio-3-keto-5-phenyl-pent-1-en-2-olate Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)C(=C[N+]#N)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)/C(=C\[N+]#N)/[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H17N3O4/c20-21-12-17(23)18(24)16(11-14-7-3-1-4-8-14)22-19(25)26-13-15-9-5-2-6-10-15/h1-10,12,16H,11,13H2,(H-,22,23,25)/b17-12+