methyl 4-(4-hydroxyphenyl)-4-[4-(quinolin-2-ylmethoxy)phenyl]pentanoate

Systemtic Name: methyl 4-(4-hydroxyphenyl)-4-[4-(quinolin-2-ylmethoxy)phenyl]pentanoate Openeye Name: methyl 4-(4-hydroxyphenyl)-4-[4-(2-quinolylmethoxy)phenyl]pentanoate CAS Name: 4-(4-hydroxyphenyl)-4-[4-(2-quinolinylmethoxy)phenyl]pentanoic acid methyl ester IUPAC Name: methyl 4-(4-hydroxyphenyl)-4-[4-(quinolin-2-ylmethoxy)phenyl]pentanoate Traditional Name: 4-(4-hydroxyphenyl)-4-[4-(2-quinolylmethoxy)phenyl]valeric acid methyl ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OC)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(CCC(=O)OC)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H27NO4/c1-28(18-17-27(31)32-2,21-8-13-24(30)14-9-21)22-10-15-25(16-11-22)33-19-23-12-7-20-5-3-4-6-26(20)29-23/h3-16,30H,17-19H2,1-2H3