N-(2-hexoxy-4-nitro-phenyl)methanesulfonamide

Systemtic Name: N-(2-hexoxy-4-nitro-phenyl)methanesulfonamide Openeye Name: N-(2-hexoxy-4-nitro-phenyl)methanesulfonamide CAS Name: N-(2-hexoxy-4-nitrophenyl)methanesulfonamide IUPAC Name: N-(2-hexoxy-4-nitrophenyl)methanesulfonamide Traditional Name: N-(2-hexoxy-4-nitro-phenyl)methanesulfonamide Formula: C13H20N2O5S MolecularWeight: 316.3733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C

InChI

InChI=1S/C13H20N2O5S/c1-3-4-5-6-9-20-13-10-11(15(16)17)7-8-12(13)14-21(2,18)19/h7-8,10,14H,3-6,9H2,1-2H3