2,6-dinitro-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]phenol

Systemtic Name: 2,6-dinitro-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]phenol Openeye Name: 2,6-dinitro-4-(1-phenyltetrazol-5-yl)sulfanyl-phenol CAS Name: 2,6-dinitro-4-[(1-phenyl-5-tetrazolyl)thio]phenol IUPAC Name: 2,6-dinitro-4-(1-phenyltetrazol-5-yl)sulfanylphenol Traditional Name: 2,6-dinitro-4-[(1-phenyltetrazol-5-yl)thio]phenol Formula: C13H8N6O5S MolecularWeight: 360.30482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=CC(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=CC(=C(C(=C3)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C13H8N6O5S/c20-12-10(18(21)22)6-9(7-11(12)19(23)24)25-13-14-15-16-17(13)8-4-2-1-3-5-8/h1-7,20H