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

Systemtic Name: 9-(3,4-dimethoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine Openeye Name: 9-(3,4-dimethoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine CAS Name: 9-(3,4-dimethoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)-6-purinamine IUPAC Name: 9-(3,4-dimethoxyphenyl)-N,N,8-tris(3,4,5-trimethoxyphenyl)purin-6-amine Traditional Name: [9-(3,4-dimethoxyphenyl)-8-(3,4,5-trimethoxyphenyl)purin-6-yl]-bis(3,4,5-trimethoxyphenyl)amine Formula: C40H43N5O11 MolecularWeight: 769.79632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=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)OC

Isomeric SMILES

COC1=C(C=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)OC

InChI

InChI=1S/C40H43N5O11/c1-46-26-13-12-23(16-27(26)47-2)45-38(22-14-28(48-3)35(54-9)29(15-22)49-4)43-34-39(41-21-42-40(34)45)44(24-17-30(50-5)36(55-10)31(18-24)51-6)25-19-32(52-7)37(56-11)33(20-25)53-8/h12-21H,1-11H3