2-phenyl-3-[4-(quinolin-2-ylmethoxy)phenyl]but-3-enoic acid

Systemtic Name: 2-phenyl-3-[4-(quinolin-2-ylmethoxy)phenyl]but-3-enoic acid Openeye Name: 2-phenyl-3-[4-(2-quinolylmethoxy)phenyl]but-3-enoic acid CAS Name: 2-phenyl-3-[4-(2-quinolinylmethoxy)phenyl]-3-butenoic acid IUPAC Name: 2-phenyl-3-[4-(quinolin-2-ylmethoxy)phenyl]but-3-enoic acid Traditional Name: 2-phenyl-3-[4-(2-quinolylmethoxy)phenyl]but-3-enoic acid Formula: C26H21NO3 MolecularWeight: 395.44984

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C=C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H21NO3/c1-18(25(26(28)29)21-8-3-2-4-9-21)19-12-15-23(16-13-19)30-17-22-14-11-20-7-5-6-10-24(20)27-22/h2-16,25H,1,17H2,(H,28,29)