sodium 2-methyl-3-[4-[2-(4-oxidanylidene-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]propanoate

Systemtic Name: sodium 2-methyl-3-[4-[2-(4-oxidanylidene-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]propanoate Openeye Name: sodium 2-methyl-3-[4-[2-(4-oxo-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]propanoate CAS Name: sodium 2-methyl-3-[4-[2-(4-oxo-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]propanoate IUPAC Name: sodium 2-methyl-3-[4-[2-(4-oxo-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]propanoate Traditional Name: sodium 3-[4-[2-(4-keto-2H-1,3-benzoxazin-3-yl)ethoxy]phenyl]-2-methyl-propionate Formula: C20H20NNaO5 MolecularWeight: 377.36627

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OCCN2COC3=CC=CC=C3C2=O)C(=O)[O-].[Na+]

Isomeric SMILES

CC(CC1=CC=C(C=C1)OCCN2COC3=CC=CC=C3C2=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H21NO5.Na/c1-14(20(23)24)12-15-6-8-16(9-7-15)25-11-10-21-13-26-18-5-3-2-4-17(18)19(21)22;/h2-9,14H,10-13H2,1H3,(H,23,24);/q;+1/p-1