N-(2-adamantyl)-5-(4-methylphenyl)sulfonyl-2,4-bis(oxidanylidene)pentanamide

Systemtic Name: N-(2-adamantyl)-5-(4-methylphenyl)sulfonyl-2,4-bis(oxidanylidene)pentanamide Openeye Name: N-(2-adamantyl)-2,4-dioxo-5-(p-tolylsulfonyl)pentanamide CAS Name: N-(2-adamantyl)-5-(4-methylphenyl)sulfonyl-2,4-dioxopentanamide IUPAC Name: N-(2-adamantyl)-5-(4-methylphenyl)sulfonyl-2,4-dioxopentanamide Traditional Name: N-(2-adamantyl)-2,4-diketo-5-tosyl-valeramide Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)CC(=O)C(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)CC(=O)C(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C22H27NO5S/c1-13-2-4-19(5-3-13)29(27,28)12-18(24)11-20(25)22(26)23-21-16-7-14-6-15(9-16)10-17(21)8-14/h2-5,14-17,21H,6-12H2,1H3,(H,23,26)