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methyl 2-[2-(2-adamantyl)quinolin-4-yl]ethanoate

methyl 2-[2-(2-adamantyl)quinolin-4-yl]ethanoate

Systemtic Name:methyl 2-[2-(2-adamantyl)quinolin-4-yl]ethanoate
Openeye Name:methyl 2-[2-(2-adamantyl)-4-quinolyl]acetate
CAS Name:2-[2-(2-adamantyl)-4-quinolinyl]acetic acid methyl ester
IUPAC Name:methyl 2-[2-(2-adamantyl)quinolin-4-yl]acetate
Traditional Name:2-[2-(2-adamantyl)-4-quinolyl]acetic acid methyl ester
Formula: C22H25NO2
MolecularWeight: 335.4394
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=NC2=CC=CC=C21)C3C4CC5CC(C4)CC3C5


Isomeric SMILES

COC(=O)CC1=CC(=NC2=CC=CC=C21)C3C4CC5CC(C4)CC3C5


InChI

InChI=1S/C22H25NO2/c1-25-21(24)12-15-11-20(23-19-5-3-2-4-18(15)19)22-16-7-13-6-14(9-16)10-17(22)8-13/h2-5,11,13-14,16-17,22H,6-10,12H2,1H3


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