2-(4-chloranylphenoxy)-N-[5-(hydroxymethyl)-2-adamantyl]-2-methyl-propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[5-(hydroxymethyl)-2-adamantyl]-2-methyl-propanamide Openeye Name: 2-(4-chlorophenoxy)-N-[5-(hydroxymethyl)-2-adamantyl]-2-methyl-propanamide CAS Name: 2-(4-chlorophenoxy)-N-[5-(hydroxymethyl)-2-adamantyl]-2-methylpropanamide IUPAC Name: 2-(4-chlorophenoxy)-N-[5-(hydroxymethyl)-2-adamantyl]-2-methylpropanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-(5-methylol-2-adamantyl)propionamide Formula: C21H28ClNO3 MolecularWeight: 377.90492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)CO)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)CO)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H28ClNO3/c1-20(2,26-17-5-3-16(22)4-6-17)19(25)23-18-14-7-13-8-15(18)11-21(9-13,10-14)12-24/h3-6,13-15,18,24H,7-12H2,1-2H3,(H,23,25)