2-[2-[2-(4-decyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenyl]ethanoic acid

Systemtic Name: 2-[2-[2-(4-decyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenyl]ethanoic acid Openeye Name: 2-[2-[2-(4-decyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid CAS Name: 2-[2-[2-(4-decyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid IUPAC Name: 2-[2-[2-(4-decyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid Traditional Name: 2-[2-[2-(4-decyl-3-keto-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid Formula: C28H37NO5 MolecularWeight: 467.59708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)O

Isomeric SMILES

CCCCCCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)O

InChI

InChI=1S/C28H37NO5/c1-2-3-4-5-6-7-8-13-19-29-23-15-10-12-17-25(23)34-26(28(29)32)18-20-33-24-16-11-9-14-22(24)21-27(30)31/h9-12,14-17,26H,2-8,13,18-21H2,1H3,(H,30,31)