9-(4-methoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine

Systemtic Name: 9-(4-methoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine Openeye Name: 9-(4-methoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine CAS Name: 9-(4-methoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)-6-purinamine IUPAC Name: 9-(4-methoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine Traditional Name: [9-(4-methoxyphenyl)-8-(3,4,5-trimethoxyphenyl)purin-6-yl]-bis(3,4,5-trimethoxyphenyl)amine Formula: C39H41N5O10 MolecularWeight: 739.77034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C(=NC=N3)N(C4=CC(=C(C(=C4)OC)OC)OC)C5=CC(=C(C(=C5)OC)OC)OC)N=C2C6=CC(=C(C(=C6)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C(=NC=N3)N(C4=CC(=C(C(=C4)OC)OC)OC)C5=CC(=C(C(=C5)OC)OC)OC)N=C2C6=CC(=C(C(=C6)OC)OC)OC

InChI

InChI=1S/C39H41N5O10/c1-45-26-13-11-23(12-14-26)44-37(22-15-27(46-2)34(52-8)28(16-22)47-3)42-33-38(40-21-41-39(33)44)43(24-17-29(48-4)35(53-9)30(18-24)49-5)25-19-31(50-6)36(54-10)32(20-25)51-7/h11-21H,1-10H3