lithium 1-(3-ethoxy-1-phenyl-hexa-1,5-diyn-3-yl)benzotriazole

Systemtic Name: lithium 1-(3-ethoxy-1-phenyl-hexa-1,5-diyn-3-yl)benzotriazole Openeye Name: lithium 1-[1-ethoxy-1-(2-phenylethynyl)but-3-ynyl]benzotriazole CAS Name: lithium 1-(3-ethoxy-1-phenylhexa-1,5-diyn-3-yl)benzotriazole IUPAC Name: lithium 1-(3-ethoxy-1-phenylhexa-1,5-diyn-3-yl)benzotriazole Traditional Name: lithium 1-[1-ethoxy-1-(2-phenylethynyl)but-3-ynyl]benzotriazole Formula: C20H16LiN3O MolecularWeight: 321.30154

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCOC(CC#[C-])(C#CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

[Li+].CCOC(CC#[C-])(C#CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H16N3O.Li/c1-3-15-20(24-4-2,16-14-17-10-6-5-7-11-17)23-19-13-9-8-12-18(19)21-22-23;/h5-13H,4,15H2,2H3;/q-1;+1