azocan-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone

Systemtic Name: azocan-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone Openeye Name: azocan-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone CAS Name: 1-azocanyl-[4-(1,2,4-triazol-1-yl)phenyl]methanone IUPAC Name: azocan-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone Traditional Name: azocan-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone Formula: C16H20N4O MolecularWeight: 284.3562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C16H20N4O/c21-16(19-10-4-2-1-3-5-11-19)14-6-8-15(9-7-14)20-13-17-12-18-20/h6-9,12-13H,1-5,10-11H2