N-[3-oxidanylidene-1-phenyl-2-(phenylsulfonyl)hexyl]butanamide

Systemtic Name: N-[3-oxidanylidene-1-phenyl-2-(phenylsulfonyl)hexyl]butanamide Openeye Name: N-[2-(benzenesulfonyl)-3-oxo-1-phenyl-hexyl]butanamide CAS Name: N-[2-(benzenesulfonyl)-3-oxo-1-phenylhexyl]butanamide IUPAC Name: N-[2-(benzenesulfonyl)-3-oxo-1-phenylhexyl]butanamide Traditional Name: N-(2-besyl-3-keto-1-phenyl-hexyl)butyramide Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C(C1=CC=CC=C1)NC(=O)CCC)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)C(C(C1=CC=CC=C1)NC(=O)CCC)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H27NO4S/c1-3-11-19(24)22(28(26,27)18-15-9-6-10-16-18)21(23-20(25)12-4-2)17-13-7-5-8-14-17/h5-10,13-16,21-22H,3-4,11-12H2,1-2H3,(H,23,25)