sodium 5-[3-(4-ethoxycarbonyl-3-methoxy-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: sodium 5-[3-(4-ethoxycarbonyl-3-methoxy-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate Openeye Name: sodium 5-[3-(4-ethoxycarbonyl-3-methoxy-phenoxy)-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylate CAS Name: sodium 5-[3-(4-ethoxycarbonyl-3-methoxyphenoxy)-2-hydroxypropoxy]-4-oxo-1-benzopyran-2-carboxylate IUPAC Name: sodium 5-[3-(4-ethoxycarbonyl-3-methoxyphenoxy)-2-hydroxypropoxy]-4-oxochromene-2-carboxylate Traditional Name: sodium 5-[3-(4-carbethoxy-3-methoxy-phenoxy)-2-hydroxy-propoxy]-4-keto-chromene-2-carboxylate Formula: C23H21NaO10 MolecularWeight: 480.39661

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)OCC(COC2=CC=CC3=C2C(=O)C=C(O3)C(=O)[O-])O)OC.[Na+]

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)OCC(COC2=CC=CC3=C2C(=O)C=C(O3)C(=O)[O-])O)OC.[Na+]

InChI

InChI=1S/C23H22O10.Na/c1-3-30-23(28)15-8-7-14(9-19(15)29-2)31-11-13(24)12-32-17-5-4-6-18-21(17)16(25)10-20(33-18)22(26)27;/h4-10,13,24H,3,11-12H2,1-2H3,(H,26,27);/q;+1/p-1