1-[(1S)-1-phenylpropyl]-2H-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(1S)-1-phenylpropyl]-2H-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(1S)-1-phenylpropyl]-2H-tetrazol-5-one CAS Name: 1-[(1S)-1-phenylpropyl]-2H-tetrazol-5-one IUPAC Name: 1-[(1S)-1-phenylpropyl]-2H-tetrazol-5-one Traditional Name: 1-[(1S)-1-phenylpropyl]-2H-tetrazol-5-one Formula: C10H12N4O MolecularWeight: 204.22848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)N2C(=O)N=NN2

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)N2C(=O)N=NN2

InChI

InChI=1S/C10H12N4O/c1-2-9(8-6-4-3-5-7-8)14-10(15)11-12-13-14/h3-7,9H,2H2,1H3,(H,11,13,15)/t9-/m0/s1