2-[5-(4-aminophenyl)-1,2,3,4-tetrazol-2-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[5-(4-aminophenyl)-1,2,3,4-tetrazol-2-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[5-(4-aminophenyl)tetrazol-2-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[5-(4-aminophenyl)-2-tetrazolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[5-(4-aminophenyl)tetrazol-2-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[5-(4-aminophenyl)tetrazol-2-yl]-1-pyrrolidino-ethanone Formula: C13H16N6O MolecularWeight: 272.30574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2N=C(N=N2)C3=CC=C(C=C3)N

Isomeric SMILES

C1CCN(C1)C(=O)CN2N=C(N=N2)C3=CC=C(C=C3)N

InChI

InChI=1S/C13H16N6O/c14-11-5-3-10(4-6-11)13-15-17-19(16-13)9-12(20)18-7-1-2-8-18/h3-6H,1-2,7-9,14H2