2-[4-[2-(4-hexyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-(4-hexyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-(4-hexyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-(4-hexyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-(4-hexyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-(4-hexyl-3-keto-1,4-benzoxazin-2-yl)ethoxy]phenoxy]-2-methyl-propionic acid Formula: C26H33NO6 MolecularWeight: 455.54332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=C(C=C3)OC(C)(C)C(=O)O

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=C(C=C3)OC(C)(C)C(=O)O

InChI

InChI=1S/C26H33NO6/c1-4-5-6-9-17-27-21-10-7-8-11-22(21)32-23(24(27)28)16-18-31-19-12-14-20(15-13-19)33-26(2,3)25(29)30/h7-8,10-15,23H,4-6,9,16-18H2,1-3H3,(H,29,30)