ethyl 3-[3-[3-(2-ethyl-5-oxidanyl-4-phenyl-phenoxy)propoxy]-9-oxidanylidene-xanthen-4-yl]propanoate

Systemtic Name: ethyl 3-[3-[3-(2-ethyl-5-oxidanyl-4-phenyl-phenoxy)propoxy]-9-oxidanylidene-xanthen-4-yl]propanoate Openeye Name: ethyl 3-[3-[3-(2-ethyl-5-hydroxy-4-phenyl-phenoxy)propoxy]-9-oxo-xanthen-4-yl]propanoate CAS Name: 3-[3-[3-(2-ethyl-5-hydroxy-4-phenylphenoxy)propoxy]-9-oxo-4-xanthenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3-(2-ethyl-5-hydroxy-4-phenylphenoxy)propoxy]-9-oxoxanthen-4-yl]propanoate Traditional Name: 3-[3-[3-(2-ethyl-5-hydroxy-4-phenyl-phenoxy)propoxy]-9-keto-xanthen-4-yl]propionic acid ethyl ester Formula: C35H34O7 MolecularWeight: 566.64026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=CC=C2)O)OCCCOC3=C(C4=C(C=C3)C(=O)C5=CC=CC=C5O4)CCC(=O)OCC

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=CC=C2)O)OCCCOC3=C(C4=C(C=C3)C(=O)C5=CC=CC=C5O4)CCC(=O)OCC

InChI

InChI=1S/C35H34O7/c1-3-23-21-28(24-11-6-5-7-12-24)29(36)22-32(23)41-20-10-19-40-30-17-15-27-34(38)25-13-8-9-14-31(25)42-35(27)26(30)16-18-33(37)39-4-2/h5-9,11-15,17,21-22,36H,3-4,10,16,18-20H2,1-2H3