2-[[1-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-hexoxy-4-oxidanyl-oxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethoxy]amino]isoindole-1,3-dione

Systemtic Name: 2-[[1-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-hexoxy-4-oxidanyl-oxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethoxy]amino]isoindole-1,3-dione Openeye Name: 2-[[1-[5-(2,4-dioxopyrimidin-1-yl)-3-hexoxy-4-hydroxy-tetrahydrofuran-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethoxy]amino]isoindoline-1,3-dione CAS Name: 2-[[1-[5-(2,4-dioxo-1-pyrimidinyl)-3-hexoxy-4-hydroxy-2-oxolanyl]-2,2-bis(4-methoxyphenyl)-2-phenylethoxy]amino]isoindole-1,3-dione IUPAC Name: 2-[[1-[5-(2,4-dioxopyrimidin-1-yl)-3-hexoxy-4-hydroxyoxolan-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenylethoxy]amino]isoindole-1,3-dione Traditional Name: 2-[[1-[5-(2,4-diketopyrimidin-1-yl)-3-hexoxy-4-hydroxy-tetrahydrofuran-2-yl]-2,2-bis(4-methoxyphenyl)-2-phenyl-ethoxy]amino]isoindoline-1,3-quinone Formula: C44H46N4O10 MolecularWeight: 790.85684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1C(C(OC1C(C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)ONN5C(=O)C6=CC=CC=C6C5=O)N7C=CC(=O)NC7=O)O

Isomeric SMILES

CCCCCCOC1C(C(OC1C(C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)ONN5C(=O)C6=CC=CC=C6C5=O)N7C=CC(=O)NC7=O)O

InChI

InChI=1S/C44H46N4O10/c1-4-5-6-12-27-56-37-36(50)42(47-26-25-35(49)45-43(47)53)57-38(37)39(58-46-48-40(51)33-15-10-11-16-34(33)41(48)52)44(28-13-8-7-9-14-28,29-17-21-31(54-2)22-18-29)30-19-23-32(55-3)24-20-30/h7-11,13-26,36-39,42,46,50H,4-6,12,27H2,1-3H3,(H,45,49,53)