5-(4-phenylmethoxyphenyl)-1,3,7-tris(phenylmethyl)pyrrolo[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-(4-phenylmethoxyphenyl)-1,3,7-tris(phenylmethyl)pyrrolo[2,3-d]pyrimidine-2,4-dione Openeye Name: 1,3,7-tribenzyl-5-(4-benzyloxyphenyl)pyrrolo[2,3-d]pyrimidine-2,4-dione CAS Name: 5-(4-phenylmethoxyphenyl)-1,3,7-tris(phenylmethyl)pyrrolo[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1,3,7-tribenzyl-5-(4-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-(4-benzoxyphenyl)-1,3,7-tribenzyl-pyrrolo[2,3-d]pyrimidine-2,4-quinone Formula: C40H33N3O3 MolecularWeight: 603.70832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C2N(C(=O)N(C3=O)CC4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=C(C=C6)OCC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C2N(C(=O)N(C3=O)CC4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=C(C=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C40H33N3O3/c44-39-37-36(34-21-23-35(24-22-34)46-29-33-19-11-4-12-20-33)28-41(25-30-13-5-1-6-14-30)38(37)42(26-31-15-7-2-8-16-31)40(45)43(39)27-32-17-9-3-10-18-32/h1-24,28H,25-27,29H2