7-phenyl-5-[4-(quinolin-2-ylmethoxy)phenyl]heptanoic acid

Systemtic Name: 7-phenyl-5-[4-(quinolin-2-ylmethoxy)phenyl]heptanoic acid Openeye Name: 7-phenyl-5-[4-(2-quinolylmethoxy)phenyl]heptanoic acid CAS Name: 7-phenyl-5-[4-(2-quinolinylmethoxy)phenyl]heptanoic acid IUPAC Name: 7-phenyl-5-[4-(quinolin-2-ylmethoxy)phenyl]heptanoic acid Traditional Name: 7-phenyl-5-[4-(2-quinolylmethoxy)phenyl]enanthic acid Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29NO3/c31-29(32)12-6-10-23(14-13-22-7-2-1-3-8-22)24-16-19-27(20-17-24)33-21-26-18-15-25-9-4-5-11-28(25)30-26/h1-5,7-9,11,15-20,23H,6,10,12-14,21H2,(H,31,32)