2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-pentyl-ethanamide

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-pentyl-ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)-N-pentyl-acetamide CAS Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-pentylacetamide IUPAC Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-pentylacetamide Traditional Name: N-amyl-2-(N-mesyl-2-methyl-5-nitro-anilino)acetamide Formula: C15H23N3O5S MolecularWeight: 357.42522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O5S/c1-4-5-6-9-16-15(19)11-17(24(3,22)23)14-10-13(18(20)21)8-7-12(14)2/h7-8,10H,4-6,9,11H2,1-3H3,(H,16,19)