3-acetamido-4-nitro-N-pentylsulfonyl-benzamide

Systemtic Name: 3-acetamido-4-nitro-N-pentylsulfonyl-benzamide Openeye Name: 3-acetamido-4-nitro-N-pentylsulfonyl-benzamide CAS Name: 3-acetamido-4-nitro-N-pentylsulfonylbenzamide IUPAC Name: 3-acetamido-4-nitro-N-pentylsulfonylbenzamide Traditional Name: 3-acetamido-N-amylsulfonyl-4-nitro-benzamide Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C14H19N3O6S/c1-3-4-5-8-24(22,23)16-14(19)11-6-7-13(17(20)21)12(9-11)15-10(2)18/h6-7,9H,3-5,8H2,1-2H3,(H,15,18)(H,16,19)