3-[5-(4-cyclopentyloxy-2-oxidanyl-phenyl)carbonyl-2-[(3-oxidanylidene-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid

Systemtic Name: 3-[5-(4-cyclopentyloxy-2-oxidanyl-phenyl)carbonyl-2-[(3-oxidanylidene-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid Openeye Name: 3-[5-[4-(cyclopentoxy)-2-hydroxy-benzoyl]-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid CAS Name: 3-[5-[(4-cyclopentyloxy-2-hydroxyphenyl)-oxomethyl]-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid IUPAC Name: 3-[5-(4-cyclopentyloxy-2-hydroxybenzoyl)-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid Traditional Name: 3-[5-[4-(cyclopentoxy)-2-hydroxy-benzoyl]-2-[(3-ketoindoxazen-6-yl)methoxy]phenyl]propionic acid Formula: C29H27NO8 MolecularWeight: 517.52658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC(=C(C=C2)C(=O)C3=CC(=C(C=C3)OCC4=CC5=C(C=C4)C(=O)NO5)CCC(=O)O)O

Isomeric SMILES

C1CCC(C1)OC2=CC(=C(C=C2)C(=O)C3=CC(=C(C=C3)OCC4=CC5=C(C=C4)C(=O)NO5)CCC(=O)O)O

InChI

InChI=1S/C29H27NO8/c31-24-15-21(37-20-3-1-2-4-20)8-10-22(24)28(34)19-6-11-25(18(14-19)7-12-27(32)33)36-16-17-5-9-23-26(13-17)38-30-29(23)35/h5-6,8-11,13-15,20,31H,1-4,7,12,16H2,(H,30,35)(H,32,33)