1-[3,5-bis[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]phenyl]pyrimidine-2,4-dione

Systemtic Name: 1-[3,5-bis[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]phenyl]pyrimidine-2,4-dione Openeye Name: 1-[3,5-bis[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]phenyl]pyrimidine-2,4-dione CAS Name: 1-[3,5-bis[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenyl]pyrimidine-2,4-dione IUPAC Name: 1-[3,5-bis[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenyl]pyrimidine-2,4-dione Traditional Name: 1-[3,5-bis[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]phenyl]pyrimidine-2,4-quinone Formula: C54H48N2O8 MolecularWeight: 852.96752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4=CC(=CC(=C4)N5C=CC(=O)NC5=O)COC(C6=CC=CC=C6)(C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4=CC(=CC(=C4)N5C=CC(=O)NC5=O)COC(C6=CC=CC=C6)(C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC

InChI

InChI=1S/C54H48N2O8/c1-59-47-23-15-42(16-24-47)53(40-11-7-5-8-12-40,43-17-25-48(60-2)26-18-43)63-36-38-33-39(35-46(34-38)56-32-31-51(57)55-52(56)58)37-64-54(41-13-9-6-10-14-41,44-19-27-49(61-3)28-20-44)45-21-29-50(62-4)30-22-45/h5-35H,36-37H2,1-4H3,(H,55,57,58)