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

Systemtic Name: 3-[2-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]propanoic acid Openeye Name: 3-[2-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]propanoic acid CAS Name: 3-[2-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]propanoic acid Traditional Name: 3-[2-[3-(3-phenyl-7-propyl-indoxazen-6-yl)oxypropoxy]phenyl]propionic acid Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCOC4=CC=CC=C4CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCOC4=CC=CC=C4CCC(=O)O

InChI

InChI=1S/C28H29NO5/c1-2-9-22-25(16-15-23-27(29-34-28(22)23)21-11-4-3-5-12-21)33-19-8-18-32-24-13-7-6-10-20(24)14-17-26(30)31/h3-7,10-13,15-16H,2,8-9,14,17-19H2,1H3,(H,30,31)