1-(azepan-1-yl)-2-[5-(4-dimethylaminophenyl)-1,2,3,4-tetrazol-2-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[5-(4-dimethylaminophenyl)-1,2,3,4-tetrazol-2-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[5-(4-dimethylaminophenyl)tetrazol-2-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[5-(4-dimethylaminophenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[5-(4-dimethylaminophenyl)tetrazol-2-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[5-(4-dimethylaminophenyl)tetrazol-2-yl]ethanone Formula: C17H24N6O MolecularWeight: 328.41206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C17H24N6O/c1-21(2)15-9-7-14(8-10-15)17-18-20-23(19-17)13-16(24)22-11-5-3-4-6-12-22/h7-10H,3-6,11-13H2,1-2H3