methyl 2-[2-bromanyl-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentyl-ethanoate

Systemtic Name: methyl 2-[2-bromanyl-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentyl-ethanoate Openeye Name: methyl 2-[2-bromo-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetate CAS Name: 2-[2-bromo-4-(2-quinolinylmethoxy)phenyl]-2-cyclopentylacetic acid methyl ester IUPAC Name: methyl 2-[2-bromo-4-(quinolin-2-ylmethoxy)phenyl]-2-cyclopentylacetate Traditional Name: 2-[2-bromo-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetic acid methyl ester Formula: C24H24BrNO3 MolecularWeight: 454.35626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)Br

Isomeric SMILES

COC(=O)C(C1CCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C24H24BrNO3/c1-28-24(27)23(17-7-2-3-8-17)20-13-12-19(14-21(20)25)29-15-18-11-10-16-6-4-5-9-22(16)26-18/h4-6,9-14,17,23H,2-3,7-8,15H2,1H3