bis[2,3-bis[(4-methoxyphenyl)amino]phenyl] decanedioate

Systemtic Name: bis[2,3-bis[(4-methoxyphenyl)amino]phenyl] decanedioate Openeye Name: bis[2,3-bis(4-methoxyanilino)phenyl] decanedioate CAS Name: decanedioic acid bis[2,3-bis(4-methoxyanilino)phenyl] ester IUPAC Name: bis[2,3-bis(4-methoxyanilino)phenyl] decanedioate Traditional Name: sebacic acid bis[2,3-bis(p-anisidino)phenyl] ester Formula: C50H54N4O8 MolecularWeight: 838.98576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C(=CC=C2)OC(=O)CCCCCCCCC(=O)OC3=CC=CC(=C3NC4=CC=C(C=C4)OC)NC5=CC=C(C=C5)OC)NC6=CC=C(C=C6)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C(=CC=C2)OC(=O)CCCCCCCCC(=O)OC3=CC=CC(=C3NC4=CC=C(C=C4)OC)NC5=CC=C(C=C5)OC)NC6=CC=C(C=C6)OC

InChI

InChI=1S/C50H54N4O8/c1-57-39-27-19-35(20-28-39)51-43-13-11-15-45(49(43)53-37-23-31-41(59-3)32-24-37)61-47(55)17-9-7-5-6-8-10-18-48(56)62-46-16-12-14-44(52-36-21-29-40(58-2)30-22-36)50(46)54-38-25-33-42(60-4)34-26-38/h11-16,19-34,51-54H,5-10,17-18H2,1-4H3