3-nitro-4-oxidanyl-N-(1-thiophen-2-ylethyl)benzenesulfonamide

Systemtic Name: 3-nitro-4-oxidanyl-N-(1-thiophen-2-ylethyl)benzenesulfonamide Openeye Name: 4-hydroxy-3-nitro-N-[1-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 4-hydroxy-3-nitro-N-(1-thiophen-2-ylethyl)benzenesulfonamide IUPAC Name: 4-hydroxy-3-nitro-N-(1-thiophen-2-ylethyl)benzenesulfonamide Traditional Name: 4-hydroxy-3-nitro-N-[1-(2-thienyl)ethyl]benzenesulfonamide Formula: C12H12N2O5S2 MolecularWeight: 328.36408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CS1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O5S2/c1-8(12-3-2-6-20-12)13-21(18,19)9-4-5-11(15)10(7-9)14(16)17/h2-8,13,15H,1H3