2-(4-azanylbutyl)benzene-1,4-dicarboxamide

Systemtic Name: 2-(4-azanylbutyl)benzene-1,4-dicarboxamide Openeye Name: 2-(4-aminobutyl)terephthalamide CAS Name: 2-(4-aminobutyl)benzene-1,4-dicarboxamide IUPAC Name: 2-(4-aminobutyl)benzene-1,4-dicarboxamide Traditional Name: 2-(4-aminobutyl)terephthalamide Formula: C12H17N3O2 MolecularWeight: 235.28228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)CCCCN)C(=O)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)CCCCN)C(=O)N

InChI

InChI=1S/C12H17N3O2/c13-6-2-1-3-8-7-9(11(14)16)4-5-10(8)12(15)17/h4-5,7H,1-3,6,13H2,(H2,14,16)(H2,15,17)