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

Systemtic Name: N-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(1-cyclohexyltetrazol-5-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(1-cyclohexyl-5-tetrazolyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(1-cyclohexyltetrazol-5-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(1-cyclohexyltetrazol-5-yl)methyl]-4-nitro-benzenesulfonamide Formula: C14H18N6O4S MolecularWeight: 366.39552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H18N6O4S/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/h6-9,11,15H,1-5,10H2