cinnolin-2-ium; 2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: cinnolin-2-ium; 2-oxidanyl-2-phenyl-ethanoate Openeye Name: cinnolin-2-ium; 2-hydroxy-2-phenyl-acetate CAS Name: cinnolin-2-ium; 2-hydroxy-2-phenylacetate IUPAC Name: cinnolin-2-ium; 2-hydroxy-2-phenylacetate Traditional Name: cinnolin-2-ium; 2-hydroxy-2-phenyl-acetate Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)[O-])O.C1=CC=C2C(=C1)C=C[NH+]=N2

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)[O-])O.C1=CC=C2C(=C1)C=C[NH+]=N2

InChI

InChI=1S/C8H6N2.C8H8O3/c1-2-4-8-7(3-1)5-6-9-10-8;9-7(8(10)11)6-4-2-1-3-5-6/h1-6H;1-5,7,9H,(H,10,11)