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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3C=NN=N3

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3C=NN=N3

InChI

InChI=1S/C14H12N6O4S/c1-10-13(3-2-4-14(10)19-9-15-17-18-19)16-25(23,24)12-7-5-11(6-8-12)20(21)22/h2-9,16H,1H3