methyl 2-cycloheptyl-2-[2-fluoranyl-4-(quinolin-2-ylmethoxy)phenyl]ethanoate

Systemtic Name: methyl 2-cycloheptyl-2-[2-fluoranyl-4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: methyl 2-cycloheptyl-2-[2-fluoro-4-(2-quinolylmethoxy)phenyl]acetate CAS Name: 2-cycloheptyl-2-[2-fluoro-4-(2-quinolinylmethoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-cycloheptyl-2-[2-fluoro-4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-cycloheptyl-2-[2-fluoro-4-(2-quinolylmethoxy)phenyl]acetic acid methyl ester Formula: C26H28FNO3 MolecularWeight: 421.503823

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)F

Isomeric SMILES

COC(=O)C(C1CCCCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)F

InChI

InChI=1S/C26H28FNO3/c1-30-26(29)25(19-9-4-2-3-5-10-19)22-15-14-21(16-23(22)27)31-17-20-13-12-18-8-6-7-11-24(18)28-20/h6-8,11-16,19,25H,2-5,9-10,17H2,1H3