1-[(E)-2-ethoxy-6-phenyl-hex-5-en-3-yn-2-yl]benzotriazole

Systemtic Name: 1-[(E)-2-ethoxy-6-phenyl-hex-5-en-3-yn-2-yl]benzotriazole Openeye Name: 1-[(E)-1-ethoxy-1-methyl-5-phenyl-pent-4-en-2-ynyl]benzotriazole CAS Name: 1-[(E)-2-ethoxy-6-phenylhex-5-en-3-yn-2-yl]benzotriazole IUPAC Name: 1-[(E)-2-ethoxy-6-phenylhex-5-en-3-yn-2-yl]benzotriazole Traditional Name: 1-[(E)-1-ethoxy-1-methyl-5-phenyl-pent-4-en-2-ynyl]benzotriazole Formula: C20H19N3O MolecularWeight: 317.38436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(C#CC=CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(C)(C#C/C=C/C1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H19N3O/c1-3-24-20(2,16-10-9-13-17-11-5-4-6-12-17)23-19-15-8-7-14-18(19)21-22-23/h4-9,11-15H,3H2,1-2H3/b13-9+