N-(1-adamantyl)-1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]piperidine-3-carboxamide Openeye Name: N-(1-adamantyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-(1-adamantyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-(1-adamantyl)-1-(2,6-dichlorobenzyl)sulfonyl-nipecotamide Formula: C23H30Cl2N2O3S MolecularWeight: 485.4669

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=C(C=CC=C2Cl)Cl)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=C(C=CC=C2Cl)Cl)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30Cl2N2O3S/c24-20-4-1-5-21(25)19(20)14-31(29,30)27-6-2-3-18(13-27)22(28)26-23-10-15-7-16(11-23)9-17(8-15)12-23/h1,4-5,15-18H,2-3,6-14H2,(H,26,28)