(3-fluoranyl-4-methoxy-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H26FNO4 MolecularWeight: 375.433843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)F

InChI

InChI=1S/C21H26FNO4/c1-26-18-3-2-13(7-17(18)22)12-27-19(24)11-23-20(25)21-8-14-4-15(9-21)6-16(5-14)10-21/h2-3,7,14-16H,4-6,8-12H2,1H3,(H,23,25)