ethyl 4-[3-(4-ethoxycarbonyl-3-oxidanyl-phenoxy)-2-oxidanyl-propoxy]-2-oxidanyl-benzoate

Systemtic Name: ethyl 4-[3-(4-ethoxycarbonyl-3-oxidanyl-phenoxy)-2-oxidanyl-propoxy]-2-oxidanyl-benzoate Openeye Name: ethyl 4-[3-(4-ethoxycarbonyl-3-hydroxy-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-benzoate CAS Name: 4-[3-(4-ethoxycarbonyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-2-hydroxybenzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-ethoxycarbonyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-2-hydroxybenzoate Traditional Name: 4-[3-(4-carbethoxy-3-hydroxy-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-benzoic acid ethyl ester Formula: C21H24O9 MolecularWeight: 420.40986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)OCC(COC2=CC(=C(C=C2)C(=O)OCC)O)O)O

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)OCC(COC2=CC(=C(C=C2)C(=O)OCC)O)O)O

InChI

InChI=1S/C21H24O9/c1-3-27-20(25)16-7-5-14(9-18(16)23)29-11-13(22)12-30-15-6-8-17(19(24)10-15)21(26)28-4-2/h5-10,13,22-24H,3-4,11-12H2,1-2H3