3-[[4-(4-chlorophenyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[[4-(4-chlorophenyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one Openeye Name: 3-[[4-(4-chlorophenyl)-5-oxo-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one CAS Name: 3-[[4-(4-chlorophenyl)-5-oxo-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one IUPAC Name: 3-[[4-(4-chlorophenyl)-5-oxo-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one Traditional Name: 3-[[4-(4-chlorophenyl)-5-keto-1H-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one Formula: C17H12ClN5O2 MolecularWeight: 353.76248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CC3=NNC(=O)N3C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CC3=NNC(=O)N3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H12ClN5O2/c18-10-5-7-11(8-6-10)23-15(21-22-17(23)25)9-14-16(24)20-13-4-2-1-3-12(13)19-14/h1-8H,9H2,(H,20,24)(H,22,25)