N,4-dimethyl-3-nitro-N-pentan-3-yl-benzenesulfonamide

Systemtic Name: N,4-dimethyl-3-nitro-N-pentan-3-yl-benzenesulfonamide Openeye Name: N-(1-ethylpropyl)-N,4-dimethyl-3-nitro-benzenesulfonamide CAS Name: N,4-dimethyl-3-nitro-N-pentan-3-ylbenzenesulfonamide IUPAC Name: N,4-dimethyl-3-nitro-N-pentan-3-ylbenzenesulfonamide Traditional Name: N-(1-ethylpropyl)-N,4-dimethyl-3-nitro-benzenesulfonamide Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S/c1-5-11(6-2)14(4)20(18,19)12-8-7-10(3)13(9-12)15(16)17/h7-9,11H,5-6H2,1-4H3