5-methylsulfonyl-1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrazole

Systemtic Name: 5-methylsulfonyl-1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrazole Openeye Name: 5-methylsulfonyl-1-[(4-nitrophenyl)methyl]tetrazole CAS Name: 5-methylsulfonyl-1-[(4-nitrophenyl)methyl]tetrazole IUPAC Name: 5-methylsulfonyl-1-[(4-nitrophenyl)methyl]tetrazole Traditional Name: 5-mesyl-1-(4-nitrobenzyl)tetrazole Formula: C9H9N5O4S MolecularWeight: 283.26386

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NN=NN1CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=NN=NN1CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O4S/c1-19(17,18)9-10-11-12-13(9)6-7-2-4-8(5-3-7)14(15)16/h2-5H,6H2,1H3