N-(4-nitro-2-pentan-3-yloxy-phenyl)methanesulfonamide

Systemtic Name: N-(4-nitro-2-pentan-3-yloxy-phenyl)methanesulfonamide Openeye Name: N-[2-(1-ethylpropoxy)-4-nitro-phenyl]methanesulfonamide CAS Name: N-(4-nitro-2-pentan-3-yloxyphenyl)methanesulfonamide IUPAC Name: N-(4-nitro-2-pentan-3-yloxyphenyl)methanesulfonamide Traditional Name: N-[2-(1-ethylpropoxy)-4-nitro-phenyl]methanesulfonamide Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C

Isomeric SMILES

CCC(CC)OC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C

InChI

InChI=1S/C12H18N2O5S/c1-4-10(5-2)19-12-8-9(14(15)16)6-7-11(12)13-20(3,17)18/h6-8,10,13H,4-5H2,1-3H3