2-(4-chloranyl-2-methyl-phenoxy)-2-methyl-N-[(1R,3S)-5-oxidanyl-2-adamantyl]propanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-2-methyl-N-[(1R,3S)-5-oxidanyl-2-adamantyl]propanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-[(1R,3S)-5-hydroxy-2-adamantyl]-2-methyl-propanamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[(1R,3S)-5-hydroxy-2-adamantyl]-2-methylpropanamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-[(1R,3S)-5-hydroxy-2-adamantyl]-2-methylpropanamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-[(1R,3S)-5-hydroxy-2-adamantyl]-2-methyl-propionamide Formula: C21H28ClNO3 MolecularWeight: 377.90492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)(C)C(=O)NC2C3CC4CC2CC(C4)(C3)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C)(C)C(=O)NC2[C@@H]3CC4C[C@H]2CC(C3)(C4)O

InChI

InChI=1S/C21H28ClNO3/c1-12-6-16(22)4-5-17(12)26-20(2,3)19(24)23-18-14-7-13-8-15(18)11-21(25,9-13)10-14/h4-6,13-15,18,25H,7-11H2,1-3H3,(H,23,24)/t13?,14-,15+,18?,21?