2-(4-methylsulfonyl-2-nitro-phenyl)-5-phenyl-1,2,3,4-tetrazole

Systemtic Name: 2-(4-methylsulfonyl-2-nitro-phenyl)-5-phenyl-1,2,3,4-tetrazole Openeye Name: 2-(4-methylsulfonyl-2-nitro-phenyl)-5-phenyl-tetrazole CAS Name: 2-(4-methylsulfonyl-2-nitrophenyl)-5-phenyltetrazole IUPAC Name: 2-(4-methylsulfonyl-2-nitrophenyl)-5-phenyltetrazole Traditional Name: 2-(4-mesyl-2-nitro-phenyl)-5-phenyl-tetrazole Formula: C14H11N5O4S MolecularWeight: 345.33324

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2N=C(N=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2N=C(N=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O4S/c1-24(22,23)11-7-8-12(13(9-11)19(20)21)18-16-14(15-17-18)10-5-3-2-4-6-10/h2-9H,1H3