5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(4-bromophenyl)-6-cyclooctyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C22H26BrN3O2 MolecularWeight: 444.36474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=C(C=C3)Br)C4CCCCCCC4

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=C(C=C3)Br)C4CCCCCCC4

InChI

InChI=1S/C22H26BrN3O2/c1-24-18-14-26(17-8-6-4-3-5-7-9-17)20(15-10-12-16(23)13-11-15)19(18)21(27)25(2)22(24)28/h10-14,17H,3-9H2,1-2H3