4-(benzotriazol-1-yl)-4-(5-methyl-4-phenyl-furan-2-yl)-1,3-diphenyl-octan-1-one

Systemtic Name: 4-(benzotriazol-1-yl)-4-(5-methyl-4-phenyl-furan-2-yl)-1,3-diphenyl-octan-1-one Openeye Name: 4-(benzotriazol-1-yl)-4-(5-methyl-4-phenyl-2-furyl)-1,3-diphenyl-octan-1-one CAS Name: 4-(1-benzotriazolyl)-4-(5-methyl-4-phenyl-2-furanyl)-1,3-diphenyl-1-octanone IUPAC Name: 4-(benzotriazol-1-yl)-4-(5-methyl-4-phenylfuran-2-yl)-1,3-diphenyloctan-1-one Traditional Name: 4-(benzotriazol-1-yl)-4-(5-methyl-4-phenyl-2-furyl)-1,3-diphenyl-octan-1-one Formula: C37H35N3O2 MolecularWeight: 553.6927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(O1)C)C2=CC=CC=C2)(C(CC(=O)C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CCCCC(C1=CC(=C(O1)C)C2=CC=CC=C2)(C(CC(=O)C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C37H35N3O2/c1-3-4-24-37(40-34-23-15-14-22-33(34)38-39-40,36-25-31(27(2)42-36)28-16-8-5-9-17-28)32(29-18-10-6-11-19-29)26-35(41)30-20-12-7-13-21-30/h5-23,25,32H,3-4,24,26H2,1-2H3