N-[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[(3-fluoro-4-methyl-benzyl)amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C21H27FN2O2 MolecularWeight: 358.449683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)F

InChI

InChI=1S/C21H27FN2O2/c1-13-2-3-14(7-18(13)22)11-23-19(25)12-24-20(26)21-8-15-4-16(9-21)6-17(5-15)10-21/h2-3,7,15-17H,4-6,8-12H2,1H3,(H,23,25)(H,24,26)