6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1H-1,2,4-triazol-5-yl)hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1H-1,2,4-triazol-5-yl)hexanamide Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-N-(1H-1,2,4-triazol-5-yl)hexanamide CAS Name: 6-(1,3-dioxo-2-isoindolyl)-N-(1H-1,2,4-triazol-5-yl)hexanamide IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-N-(1H-1,2,4-triazol-5-yl)hexanamide Traditional Name: 6-phthalimido-N-(1H-1,2,4-triazol-5-yl)hexanamide Formula: C16H17N5O3 MolecularWeight: 327.33788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)NC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)NC3=NC=NN3

InChI

InChI=1S/C16H17N5O3/c22-13(19-16-17-10-18-20-16)8-2-1-5-9-21-14(23)11-6-3-4-7-12(11)15(21)24/h3-4,6-7,10H,1-2,5,8-9H2,(H2,17,18,19,20,22)