(Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-oxidanyl-3-oxidanylidene-pent-1-en-1-olate

Systemtic Name: (Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-oxidanyl-3-oxidanylidene-pent-1-en-1-olate Openeye Name: (Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-hydroxy-3-oxo-pent-1-en-1-olate CAS Name: (Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-hydroxy-3-oxo-1-penten-1-olate IUPAC Name: (Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-hydroxy-3-oxopent-1-en-1-olate Traditional Name: (Z)-5-(4-benzamidophenyl)-2-diazonio-1-ethoxy-5-hydroxy-3-keto-pent-1-en-1-olate Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5/c1-2-28-20(27)18(23-21)17(25)12-16(24)13-8-10-15(11-9-13)22-19(26)14-6-4-3-5-7-14/h3-11,16,24H,2,12H2,1H3,(H-,22,25,26,27)