lithium (E)-1-(benzotriazol-1-yl)oct-1-en-1-olate

Systemtic Name: lithium (E)-1-(benzotriazol-1-yl)oct-1-en-1-olate Openeye Name: lithium (E)-1-(benzotriazol-1-yl)oct-1-en-1-olate CAS Name: lithium (E)-1-(1-benzotriazolyl)-1-octen-1-olate IUPAC Name: lithium (E)-1-(benzotriazol-1-yl)oct-1-en-1-olate Traditional Name: lithium (E)-1-(benzotriazol-1-yl)oct-1-en-1-olate Formula: C14H18LiN3O MolecularWeight: 251.25322

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCC=C(N1C2=CC=CC=C2N=N1)[O-]

Isomeric SMILES

[Li+].CCCCCC/C=C(\N1C2=CC=CC=C2N=N1)/[O-]

InChI

InChI=1S/C14H19N3O.Li/c1-2-3-4-5-6-11-14(18)17-13-10-8-7-9-12(13)15-16-17;/h7-11,18H,2-6H2,1H3;/q;+1/p-1/b14-11+;