3-[4-[(2-methoxy-6-phenyl-pyridin-3-yl)methoxy]phenyl]hex-4-ynoic acid

Systemtic Name: 3-[4-[(2-methoxy-6-phenyl-pyridin-3-yl)methoxy]phenyl]hex-4-ynoic acid Openeye Name: 3-[4-[(2-methoxy-6-phenyl-3-pyridyl)methoxy]phenyl]hex-4-ynoic acid CAS Name: 3-[4-[(2-methoxy-6-phenyl-3-pyridinyl)methoxy]phenyl]-4-hexynoic acid IUPAC Name: 3-[4-[(2-methoxy-6-phenylpyridin-3-yl)methoxy]phenyl]hex-4-ynoic acid Traditional Name: 3-[4-[(2-methoxy-6-phenyl-3-pyridyl)methoxy]phenyl]hex-4-ynoic acid Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(CC(=O)O)C1=CC=C(C=C1)OCC2=C(N=C(C=C2)C3=CC=CC=C3)OC

Isomeric SMILES

CC#CC(CC(=O)O)C1=CC=C(C=C1)OCC2=C(N=C(C=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C25H23NO4/c1-3-7-20(16-24(27)28)18-10-13-22(14-11-18)30-17-21-12-15-23(26-25(21)29-2)19-8-5-4-6-9-19/h4-6,8-15,20H,16-17H2,1-2H3,(H,27,28)