sodium 2-ethoxy-3-[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]propanoate

Systemtic Name: sodium 2-ethoxy-3-[4-[2-[(4-pyridin-2-ylphenyl)carbonylamino]ethoxy]phenyl]propanoate Openeye Name: sodium 2-ethoxy-3-[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]phenyl]propanoate CAS Name: sodium 2-ethoxy-3-[4-[2-[[oxo-[4-(2-pyridinyl)phenyl]methyl]amino]ethoxy]phenyl]propanoate IUPAC Name: sodium 2-ethoxy-3-[4-[2-[(4-pyridin-2-ylbenzoyl)amino]ethoxy]phenyl]propanoate Traditional Name: sodium 2-ethoxy-3-[4-[2-[[4-(2-pyridyl)benzoyl]amino]ethoxy]phenyl]propionate Formula: C25H25N2NaO5 MolecularWeight: 456.46617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCNC(=O)C2=CC=C(C=C2)C3=CC=CC=N3)C(=O)[O-].[Na+]

InChI

InChI=1S/C25H26N2O5.Na/c1-2-31-23(25(29)30)17-18-6-12-21(13-7-18)32-16-15-27-24(28)20-10-8-19(9-11-20)22-5-3-4-14-26-22;/h3-14,23H,2,15-17H2,1H3,(H,27,28)(H,29,30);/q;+1/p-1