3-chloranyl-N-[1-(2,5-dimethylphenyl)ethyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[1-(2,5-dimethylphenyl)ethyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[1-(2,5-dimethylphenyl)ethyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[1-(2,5-dimethylphenyl)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[1-(2,5-dimethylphenyl)ethyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[1-(2,5-dimethylphenyl)ethyl]adamantane-1-carboxamide Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO/c1-13-4-5-14(2)18(6-13)15(3)23-19(24)20-8-16-7-17(9-20)11-21(22,10-16)12-20/h4-6,15-17H,7-12H2,1-3H3,(H,23,24)