(2S)-2-phenyl-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (2S)-2-phenyl-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (2S)-2-phenyl-2-(5-phenyltetrazol-2-yl)acetate CAS Name: (2S)-2-phenyl-2-(5-phenyl-2-tetrazolyl)acetate IUPAC Name: (2S)-2-phenyl-2-(5-phenyltetrazol-2-yl)acetate Traditional Name: (2S)-2-phenyl-2-(5-phenyltetrazol-2-yl)acetate Formula: C15H11N4O2- MolecularWeight: 279.27344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)C(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C15H12N4O2/c20-15(21)13(11-7-3-1-4-8-11)19-17-14(16-18-19)12-9-5-2-6-10-12/h1-10,13H,(H,20,21)/p-1/t13-/m0/s1