(E)-(5-diazonio-2-phenylazanyl-cyclohexa-2,5-dien-1-ylidene)-oxidanyl-methanolate

Systemtic Name: (E)-(5-diazonio-2-phenylazanyl-cyclohexa-2,5-dien-1-ylidene)-oxidanyl-methanolate Openeye Name: (E)-(2-anilino-5-diazonio-cyclohexa-2,5-dien-1-ylidene)-hydroxy-methanolate CAS Name: (E)-(2-anilino-5-diazonio-1-cyclohexa-2,5-dienylidene)-hydroxymethanolate IUPAC Name: (E)-(2-anilino-5-diazoniocyclohexa-2,5-dien-1-ylidene)-hydroxymethanolate Traditional Name: (E)-(2-anilino-5-diazonio-cyclohexa-2,5-dien-1-ylidene)-hydroxy-methanolate Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=C(O)[O-])C=C1[N+]#N)NC2=CC=CC=C2

Isomeric SMILES

C1C=C(/C(=C(/O)\[O-])/C=C1[N+]#N)NC2=CC=CC=C2

InChI

InChI=1S/C13H11N3O2/c14-16-10-6-7-12(11(8-10)13(17)18)15-9-4-2-1-3-5-9/h1-5,7-8,15H,6H2,(H-,17,18)