4-diazo-N-ethyl-N-(phenylmethyl)cyclohexa-1,5-dien-1-amine; fluoranylboronic acid

Systemtic Name: 4-diazo-N-ethyl-N-(phenylmethyl)cyclohexa-1,5-dien-1-amine; fluoranylboronic acid Openeye Name: N-benzyl-4-diazo-N-ethyl-cyclohexa-1,5-dien-1-amine; fluoroboronic acid CAS Name: 4-diazo-N-ethyl-N-(phenylmethyl)-1-cyclohexa-1,5-dienamine; fluoroboronic acid IUPAC Name: N-benzyl-4-diazo-N-ethylcyclohexa-1,5-dien-1-amine; fluoroboronic acid Traditional Name: benzyl-(4-diazocyclohexa-1,5-dien-1-yl)-ethyl-amine; fluoroboronic acid Formula: C15H25B4F4N3O8 MolecularWeight: 494.611913

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)F.B(O)(O)F.B(O)(O)F.B(O)(O)F.CCN(CC1=CC=CC=C1)C2=CCC(=[N+]=[N-])C=C2

Isomeric SMILES

B(O)(O)F.B(O)(O)F.B(O)(O)F.B(O)(O)F.CCN(CC1=CC=CC=C1)C2=CCC(=[N+]=[N-])C=C2

InChI

InChI=1S/C15H17N3.4BFH2O2/c1-2-18(12-13-6-4-3-5-7-13)15-10-8-14(17-16)9-11-15;4*2-1(3)4/h3-8,10-11H,2,9,12H2,1H3;4*3-4H