1-[4-chloranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidin-4-one

Systemtic Name: 1-[4-chloranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidin-4-one Openeye Name: 1-[4-chloro-2-(tetrazol-1-yl)benzoyl]piperidin-4-one CAS Name: 1-[[4-chloro-2-(1-tetrazolyl)phenyl]-oxomethyl]-4-piperidinone IUPAC Name: 1-[4-chloro-2-(tetrazol-1-yl)benzoyl]piperidin-4-one Traditional Name: 1-[4-chloro-2-(tetrazol-1-yl)benzoyl]-4-piperidone Formula: C13H12ClN5O2 MolecularWeight: 305.71968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C(=O)C2=C(C=C(C=C2)Cl)N3C=NN=N3

Isomeric SMILES

C1CN(CCC1=O)C(=O)C2=C(C=C(C=C2)Cl)N3C=NN=N3

InChI

InChI=1S/C13H12ClN5O2/c14-9-1-2-11(12(7-9)19-8-15-16-17-19)13(21)18-5-3-10(20)4-6-18/h1-2,7-8H,3-6H2