N-(1-adamantyl)-1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(1-adamantyl)-1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(1-adamantyl)-1-[(3-chlorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(1-adamantyl)-1-(3-chlorobenzyl)sulfonyl-isonipecotamide Formula: C23H31ClN2O3S MolecularWeight: 451.02184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=CC(=CC=C5)Cl

InChI

InChI=1S/C23H31ClN2O3S/c24-21-3-1-2-16(11-21)15-30(28,29)26-6-4-20(5-7-26)22(27)25-23-12-17-8-18(13-23)10-19(9-17)14-23/h1-3,11,17-20H,4-10,12-15H2,(H,25,27)