3-[4-[2-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]ethoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]ethoxy]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]ethoxy]phenyl]propanoic acid CAS Name: 3-[4-[2-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]ethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]ethoxy]phenyl]propanoic acid Traditional Name: 3-[4-[2-(3-phenyl-7-propyl-indoxazen-6-yl)oxyethoxy]phenyl]propionic acid Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCOC4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCOC4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C27H27NO5/c1-2-6-22-24(15-14-23-26(28-33-27(22)23)20-7-4-3-5-8-20)32-18-17-31-21-12-9-19(10-13-21)11-16-25(29)30/h3-5,7-10,12-15H,2,6,11,16-18H2,1H3,(H,29,30)