oxidanium zinc 2-methoxy-6-[(E)-pyridin-4-ylcarbonylazanidyliminomethyl]phenolate

Systemtic Name: oxidanium zinc 2-methoxy-6-[(E)-pyridin-4-ylcarbonylazanidyliminomethyl]phenolate Openeye Name: oxonium zinc 2-methoxy-6-[(E)-pyridine-4-carbonylazanidyliminomethyl]phenolate CAS Name: oxonium zinc 2-methoxy-6-[(E)-[oxo(pyridin-4-yl)methyl]azanidyliminomethyl]phenolate IUPAC Name: oxidanium zinc 2-methoxy-6-[(E)-pyridine-4-carbonylazanidyliminomethyl]phenolate Traditional Name: oxonium zinc 2-[(E)-isonicotinoylazanidyliminomethyl]-6-methoxy-phenolate Formula: C14H14N3O4Zn+ MolecularWeight: 353.68766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[O-])C=N[N-]C(=O)C2=CC=NC=C2.[OH3+].[Zn+2]

Isomeric SMILES

COC1=CC=CC(=C1[O-])/C=N/[N-]C(=O)C2=CC=NC=C2.[OH3+].[Zn+2]

InChI

InChI=1S/C14H13N3O3.H2O.Zn/c1-20-12-4-2-3-11(13(12)18)9-16-17-14(19)10-5-7-15-8-6-10;;/h2-9H,1H3,(H2,15,16,17,18,19);1H2;/q;;+2/p-1