N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]hexanamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]hexanamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]hexanamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]hexanamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]hexanamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]hexanamide Formula: C15H23N3O5S MolecularWeight: 357.42522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NCCNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(=O)NCCNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

InChI

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