2-(benzotriazol-1-yl)-2-ethoxy-1-phenyl-dec-3-yn-1-one

Systemtic Name: 2-(benzotriazol-1-yl)-2-ethoxy-1-phenyl-dec-3-yn-1-one Openeye Name: 2-(benzotriazol-1-yl)-2-ethoxy-1-phenyl-dec-3-yn-1-one CAS Name: 2-(1-benzotriazolyl)-2-ethoxy-1-phenyl-3-decyn-1-one IUPAC Name: 2-(benzotriazol-1-yl)-2-ethoxy-1-phenyldec-3-yn-1-one Traditional Name: 2-(benzotriazol-1-yl)-2-ethoxy-1-phenyl-dec-3-yn-1-one Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C(=O)C1=CC=CC=C1)(N2C3=CC=CC=C3N=N2)OCC

Isomeric SMILES

CCCCCCC#CC(C(=O)C1=CC=CC=C1)(N2C3=CC=CC=C3N=N2)OCC

InChI

InChI=1S/C24H27N3O2/c1-3-5-6-7-8-14-19-24(29-4-2,23(28)20-15-10-9-11-16-20)27-22-18-13-12-17-21(22)25-26-27/h9-13,15-18H,3-8H2,1-2H3