4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)-1-(phenylmethyl)-1,2,3-triazole

Systemtic Name: 4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)-1-(phenylmethyl)-1,2,3-triazole Openeye Name: 1-benzyl-4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)triazole CAS Name: 4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)-1-(phenylmethyl)triazole IUPAC Name: 1-benzyl-4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)triazole Traditional Name: 1-benzyl-4-(phenoxymethyl)-5-(3-phenoxyprop-1-ynyl)triazole Formula: C25H21N3O2 MolecularWeight: 395.45314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(N=N2)COC3=CC=CC=C3)C#CCOC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(N=N2)COC3=CC=CC=C3)C#CCOC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2/c1-4-11-21(12-5-1)19-28-25(17-10-18-29-22-13-6-2-7-14-22)24(26-27-28)20-30-23-15-8-3-9-16-23/h1-9,11-16H,18-20H2