N-[2-(1-adamantyl)ethyl]-2-chloranyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-2-chloranyl-5-methylsulfonyl-benzamide Openeye Name: N-[2-(1-adamantyl)ethyl]-2-chloro-5-methylsulfonyl-benzamide CAS Name: N-[2-(1-adamantyl)ethyl]-2-chloro-5-methylsulfonylbenzamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-2-chloro-5-methylsulfonylbenzamide Traditional Name: N-[2-(1-adamantyl)ethyl]-2-chloro-5-mesyl-benzamide Formula: C20H26ClNO3S MolecularWeight: 395.94334

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26ClNO3S/c1-26(24,25)16-2-3-18(21)17(9-16)19(23)22-5-4-20-10-13-6-14(11-20)8-15(7-13)12-20/h2-3,9,13-15H,4-8,10-12H2,1H3,(H,22,23)