4-nitro-N-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]benzenesulfonamide Openeye Name: 4-nitro-N-[(1-phenyltetrazol-5-yl)methyl]benzenesulfonamide CAS Name: 4-nitro-N-[(1-phenyl-5-tetrazolyl)methyl]benzenesulfonamide IUPAC Name: 4-nitro-N-[(1-phenyltetrazol-5-yl)methyl]benzenesulfonamide Traditional Name: 4-nitro-N-[(1-phenyltetrazol-5-yl)methyl]benzenesulfonamide Formula: C14H12N6O4S MolecularWeight: 360.34788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N6O4S/c21-20(22)12-6-8-13(9-7-12)25(23,24)15-10-14-16-17-18-19(14)11-4-2-1-3-5-11/h1-9,15H,10H2