2-[[(2S)-2-(2-methyl-1,2,3,4-tetrazol-5-yl)-2-oxidanyl-ethyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2S)-2-(2-methyl-1,2,3,4-tetrazol-5-yl)-2-oxidanyl-ethyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(2S)-2-hydroxy-2-(2-methyltetrazol-5-yl)ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(2S)-2-hydroxy-2-(2-methyl-5-tetrazolyl)ethyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(2S)-2-hydroxy-2-(2-methyltetrazol-5-yl)ethyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(2S)-2-hydroxy-2-(2-methyltetrazol-5-yl)ethyl]iminomethyl]-4-nitro-phenolate Formula: C11H11N6O4- MolecularWeight: 291.24284

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)C(CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])O

Isomeric SMILES

CN1N=C(N=N1)[C@H](CN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])O

InChI

InChI=1S/C11H12N6O4/c1-16-14-11(13-15-16)10(19)6-12-5-7-4-8(17(20)21)2-3-9(7)18/h2-5,10,18-19H,6H2,1H3/p-1/t10-/m0/s1