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

Systemtic Name: methyl 2-cyclohexyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: methyl 2-cyclohexyl-2-[4-(2-quinolylmethoxy)phenyl]acetate CAS Name: 2-cyclohexyl-2-[4-(2-quinolinylmethoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-cyclohexyl-2-[4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-cyclohexyl-2-[4-(2-quinolylmethoxy)phenyl]acetic acid methyl ester Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCCC1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C(C1CCCCC1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H27NO3/c1-28-25(27)24(19-8-3-2-4-9-19)20-12-15-22(16-13-20)29-17-21-14-11-18-7-5-6-10-23(18)26-21/h5-7,10-16,19,24H,2-4,8-9,17H2,1H3