sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]phenoxy]ethanoate

Systemtic Name: sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]phenoxy]ethanoate Openeye Name: sodium 2-[3-[2-(4,5-diphenyloxazol-2-yl)ethyl]phenoxy]acetate CAS Name: sodium 2-[3-[2-(4,5-diphenyl-2-oxazolyl)ethyl]phenoxy]acetate IUPAC Name: sodium 2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]phenoxy]acetate Traditional Name: sodium 2-[3-[2-(4,5-diphenyloxazol-2-yl)ethyl]phenoxy]acetate Formula: C25H20NNaO4 MolecularWeight: 421.42037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=N2)CCC3=CC(=CC=C3)OCC(=O)[O-])C4=CC=CC=C4.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=N2)CCC3=CC(=CC=C3)OCC(=O)[O-])C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C25H21NO4.Na/c27-23(28)17-29-21-13-7-8-18(16-21)14-15-22-26-24(19-9-3-1-4-10-19)25(30-22)20-11-5-2-6-12-20;/h1-13,16H,14-15,17H2,(H,27,28);/q;+1/p-1