3-chloranyl-N-(2,4,6-trimethylphenyl)adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-(2,4,6-trimethylphenyl)adamantane-1-carboxamide Openeye Name: 3-chloro-N-(2,4,6-trimethylphenyl)adamantane-1-carboxamide CAS Name: 3-chloro-N-(2,4,6-trimethylphenyl)-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-(2,4,6-trimethylphenyl)adamantane-1-carboxamide Traditional Name: 3-chloro-N-mesityl-adamantane-1-carboxamide Formula: C20H26ClNO MolecularWeight: 331.87954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)C

InChI

InChI=1S/C20H26ClNO/c1-12-4-13(2)17(14(3)5-12)22-18(23)19-7-15-6-16(8-19)10-20(21,9-15)11-19/h4-5,15-16H,6-11H2,1-3H3,(H,22,23)