N-(2-nitro-6-prop-2-ynoxy-phenyl)-1H-1,2,4-triazole-5-sulfonamide

Systemtic Name: N-(2-nitro-6-prop-2-ynoxy-phenyl)-1H-1,2,4-triazole-5-sulfonamide Openeye Name: N-(2-nitro-6-prop-2-ynoxy-phenyl)-1H-1,2,4-triazole-5-sulfonamide CAS Name: N-(2-nitro-6-prop-2-ynoxyphenyl)-1H-1,2,4-triazole-5-sulfonamide IUPAC Name: N-(2-nitro-6-prop-2-ynoxyphenyl)-1H-1,2,4-triazole-5-sulfonamide Traditional Name: N-(2-nitro-6-propargyloxy-phenyl)-1H-1,2,4-triazole-5-sulfonamide Formula: C11H9N5O5S MolecularWeight: 323.28466

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC(=C1NS(=O)(=O)C2=NC=NN2)[N+](=O)[O-]

Isomeric SMILES

C#CCOC1=CC=CC(=C1NS(=O)(=O)C2=NC=NN2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O5S/c1-2-6-21-9-5-3-4-8(16(17)18)10(9)15-22(19,20)11-12-7-13-14-11/h1,3-5,7,15H,6H2,(H,12,13,14)