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

Systemtic Name: 2-[2-[2-(3-oxidanylidene-4-propyl-1,4-benzoxazin-2-yl)ethoxy]phenyl]ethanoic acid Openeye Name: 2-[2-[2-(3-oxo-4-propyl-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid CAS Name: 2-[2-[2-(3-oxo-4-propyl-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid IUPAC Name: 2-[2-[2-(3-oxo-4-propyl-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid Traditional Name: 2-[2-[2-(3-keto-4-propyl-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)O

Isomeric SMILES

CCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)O

InChI

InChI=1S/C21H23NO5/c1-2-12-22-16-8-4-6-10-18(16)27-19(21(22)25)11-13-26-17-9-5-3-7-15(17)14-20(23)24/h3-10,19H,2,11-14H2,1H3,(H,23,24)