1-[(2S)-2-azanylpropyl]-4-phenyl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(2S)-2-azanylpropyl]-4-phenyl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(2S)-2-aminopropyl]-4-phenyl-tetrazol-5-one CAS Name: 1-[(2S)-2-aminopropyl]-4-phenyl-5-tetrazolone IUPAC Name: 1-[(2S)-2-aminopropyl]-4-phenyltetrazol-5-one Traditional Name: 1-[(2S)-2-aminopropyl]-4-phenyl-tetrazol-5-one Formula: C10H13N5O MolecularWeight: 219.24312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)N(N=N1)C2=CC=CC=C2)N

Isomeric SMILES

C[C@@H](CN1C(=O)N(N=N1)C2=CC=CC=C2)N

InChI

InChI=1S/C10H13N5O/c1-8(11)7-14-10(16)15(13-12-14)9-5-3-2-4-6-9/h2-6,8H,7,11H2,1H3/t8-/m0/s1