2-[4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]phenyl]ethanoic acid Openeye Name: 2-[4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]phenyl]acetic acid CAS Name: 2-[4-[4-[3-hydroxy-5-(3-pyridinyl)pentan-2-yl]oxyphenyl]phenyl]acetic acid IUPAC Name: 2-[4-[4-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxyphenyl]phenyl]acetic acid Traditional Name: 2-[4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]phenyl]acetic acid Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CN=CC=C1)O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

CC(C(CCC1=CN=CC=C1)O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C24H25NO4/c1-17(23(26)13-6-19-3-2-14-25-16-19)29-22-11-9-21(10-12-22)20-7-4-18(5-8-20)15-24(27)28/h2-5,7-12,14,16-17,23,26H,6,13,15H2,1H3,(H,27,28)