4-(3-oxidanylidene-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxy-butanoic acid

Systemtic Name: 4-(3-oxidanylidene-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxy-butanoic acid Openeye Name: 4-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxy-butanoic acid CAS Name: 4-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxybutanoic acid IUPAC Name: 4-(3-oxo-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxybutanoic acid Traditional Name: 4-(3-keto-5,6-diphenyl-1,2,4-triazin-2-yl)-2-phenoxy-butyric acid Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=CC=C3)CCC(C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=CC=C3)CCC(C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O4/c29-24(30)21(32-20-14-8-3-9-15-20)16-17-28-25(31)26-22(18-10-4-1-5-11-18)23(27-28)19-12-6-2-7-13-19/h1-15,21H,16-17H2,(H,29,30)