N-(1-adamantyl)-4-chloranyl-N-ethyl-3-methylsulfonyl-benzamide

Systemtic Name: N-(1-adamantyl)-4-chloranyl-N-ethyl-3-methylsulfonyl-benzamide Openeye Name: N-(1-adamantyl)-4-chloro-N-ethyl-3-methylsulfonyl-benzamide CAS Name: N-(1-adamantyl)-4-chloro-N-ethyl-3-methylsulfonylbenzamide IUPAC Name: N-(1-adamantyl)-4-chloro-N-ethyl-3-methylsulfonylbenzamide Traditional Name: N-(1-adamantyl)-4-chloro-N-ethyl-3-mesyl-benzamide Formula: C20H26ClNO3S MolecularWeight: 395.94334

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(C(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26ClNO3S/c1-3-22(20-10-13-6-14(11-20)8-15(7-13)12-20)19(23)16-4-5-17(21)18(9-16)26(2,24)25/h4-5,9,13-15H,3,6-8,10-12H2,1-2H3