2-[[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]methyl]hexanoic acid

Systemtic Name: 2-[[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]methyl]hexanoic acid Openeye Name: 2-[[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]phenyl]methyl]hexanoic acid CAS Name: 2-[[4-[2-[[oxo-[4-(2-pyridinyl)phenyl]methyl]amino]ethoxy]phenyl]methyl]hexanoic acid IUPAC Name: 2-[[4-[2-[(4-pyridin-2-ylbenzoyl)amino]ethoxy]phenyl]methyl]hexanoic acid Traditional Name: 2-[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]benzyl]hexanoic acid Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)C(=O)O

Isomeric SMILES

CCCCC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C27H30N2O4/c1-2-3-6-23(27(31)32)19-20-8-14-24(15-9-20)33-18-17-29-26(30)22-12-10-21(11-13-22)25-7-4-5-16-28-25/h4-5,7-16,23H,2-3,6,17-19H2,1H3,(H,29,30)(H,31,32)