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

Systemtic Name: 2-methyl-2-[3-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]propanoic acid Openeye Name: 2-methyl-2-[3-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]propanoic acid CAS Name: 2-methyl-2-[3-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]propanoic acid IUPAC Name: 2-methyl-2-[3-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]propanoic acid Traditional Name: 2-methyl-2-[3-[4-(3-phenyl-7-propyl-indoxazen-6-yl)oxybutoxy]phenyl]propionic acid Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)C(C)(C)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)C(C)(C)C(=O)O

InChI

InChI=1S/C30H33NO5/c1-4-11-24-26(17-16-25-27(31-36-28(24)25)21-12-6-5-7-13-21)35-19-9-8-18-34-23-15-10-14-22(20-23)30(2,3)29(32)33/h5-7,10,12-17,20H,4,8-9,11,18-19H2,1-3H3,(H,32,33)