2-ethyl-N-(4-methyl-2-nitro-phenyl)sulfonyl-butanamide

Systemtic Name: 2-ethyl-N-(4-methyl-2-nitro-phenyl)sulfonyl-butanamide Openeye Name: 2-ethyl-N-(4-methyl-2-nitro-phenyl)sulfonyl-butanamide CAS Name: 2-ethyl-N-(4-methyl-2-nitrophenyl)sulfonylbutanamide IUPAC Name: 2-ethyl-N-(4-methyl-2-nitrophenyl)sulfonylbutanamide Traditional Name: 2-ethyl-N-(4-methyl-2-nitro-phenyl)sulfonyl-butyramide Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5S/c1-4-10(5-2)13(16)14-21(19,20)12-7-6-9(3)8-11(12)15(17)18/h6-8,10H,4-5H2,1-3H3,(H,14,16)