sodium 2-ethoxy-3-[(2R)-2-[(4-phenylmethoxyphenyl)methyl]-2H-chromen-6-yl]propanoate

Systemtic Name: sodium 2-ethoxy-3-[(2R)-2-[(4-phenylmethoxyphenyl)methyl]-2H-chromen-6-yl]propanoate Openeye Name: sodium 3-[(2R)-2-[(4-benzyloxyphenyl)methyl]-2H-chromen-6-yl]-2-ethoxy-propanoate CAS Name: sodium 2-ethoxy-3-[(2R)-2-[(4-phenylmethoxyphenyl)methyl]-2H-1-benzopyran-6-yl]propanoate IUPAC Name: sodium 2-ethoxy-3-[(2R)-2-[(4-phenylmethoxyphenyl)methyl]-2H-chromen-6-yl]propanoate Traditional Name: sodium 3-[(2R)-2-(4-benzoxybenzyl)-2H-chromen-6-yl]-2-ethoxy-propionate Formula: C28H27NaO5 MolecularWeight: 466.50075

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC2=C(C=C1)OC(C=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC(CC1=CC2=C(C=C1)O[C@@H](C=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)[O-].[Na+]

InChI

InChI=1S/C28H28O5.Na/c1-2-31-27(28(29)30)18-22-10-15-26-23(16-22)11-14-25(33-26)17-20-8-12-24(13-9-20)32-19-21-6-4-3-5-7-21;/h3-16,25,27H,2,17-19H2,1H3,(H,29,30);/q;+1/p-1/t25-,27?;/m0./s1