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

Systemtic Name: ethyl 3-[3-[3-(2-ethyl-4-phenyl-5-phenylmethoxy-phenoxy)propoxy]-9-oxidanylidene-xanthen-4-yl]propanoate Openeye Name: ethyl 3-[3-[3-(5-benzyloxy-2-ethyl-4-phenyl-phenoxy)propoxy]-9-oxo-xanthen-4-yl]propanoate CAS Name: 3-[3-[3-(2-ethyl-4-phenyl-5-phenylmethoxyphenoxy)propoxy]-9-oxo-4-xanthenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3-(2-ethyl-4-phenyl-5-phenylmethoxyphenoxy)propoxy]-9-oxoxanthen-4-yl]propanoate Traditional Name: 3-[3-[3-(5-benzoxy-2-ethyl-4-phenyl-phenoxy)propoxy]-9-keto-xanthen-4-yl]propionic acid ethyl ester Formula: C42H40O7 MolecularWeight: 656.7628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=CC=C2)OCC3=CC=CC=C3)OCCCOC4=C(C5=C(C=C4)C(=O)C6=CC=CC=C6O5)CCC(=O)OCC

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=CC=C2)OCC3=CC=CC=C3)OCCCOC4=C(C5=C(C=C4)C(=O)C6=CC=CC=C6O5)CCC(=O)OCC

InChI

InChI=1S/C42H40O7/c1-3-30-26-35(31-16-9-6-10-17-31)39(48-28-29-14-7-5-8-15-29)27-38(30)47-25-13-24-46-36-22-20-34-41(44)32-18-11-12-19-37(32)49-42(34)33(36)21-23-40(43)45-4-2/h5-12,14-20,22,26-27H,3-4,13,21,23-25,28H2,1-2H3