4-methoxy-2-(4-methylphenyl)sulfonyl-5-oxidanylidene-N-(phenylmethyl)hexanamide

Systemtic Name: 4-methoxy-2-(4-methylphenyl)sulfonyl-5-oxidanylidene-N-(phenylmethyl)hexanamide Openeye Name: N-benzyl-4-methoxy-5-oxo-2-(p-tolylsulfonyl)hexanamide CAS Name: 4-methoxy-2-(4-methylphenyl)sulfonyl-5-oxo-N-(phenylmethyl)hexanamide IUPAC Name: N-benzyl-4-methoxy-2-(4-methylphenyl)sulfonyl-5-oxohexanamide Traditional Name: N-benzyl-5-keto-4-methoxy-2-tosyl-hexanamide Formula: C21H25NO5S MolecularWeight: 403.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C(=O)C)OC)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C(=O)C)OC)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO5S/c1-15-9-11-18(12-10-15)28(25,26)20(13-19(27-3)16(2)23)21(24)22-14-17-7-5-4-6-8-17/h4-12,19-20H,13-14H2,1-3H3,(H,22,24)