2-ethoxy-3-[4-[2-(1-oxidanylidenephthalazin-2-yl)ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-(1-oxidanylidenephthalazin-2-yl)ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-(1-oxophthalazin-2-yl)ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-(1-oxo-2-phthalazinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-(1-oxophthalazin-2-yl)ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-(1-ketophthalazin-2-yl)ethoxy]phenyl]propionic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C(=O)C3=CC=CC=C3C=N2)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C(=O)C3=CC=CC=C3C=N2)C(=O)O

InChI

InChI=1S/C21H22N2O5/c1-2-27-19(21(25)26)13-15-7-9-17(10-8-15)28-12-11-23-20(24)18-6-4-3-5-16(18)14-22-23/h3-10,14,19H,2,11-13H2,1H3,(H,25,26)