1-cyclohexyl-5-[(1S)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 1-cyclohexyl-5-[(1S)-4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 1-cyclohexyl-5-[(1S)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]-6-hydroxy-pyrimidine-2,4-dione CAS Name: 1-cyclohexyl-5-[(1S)-4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]-6-hydroxypyrimidine-2,4-dione IUPAC Name: 1-cyclohexyl-5-[(1S)-4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl]-6-hydroxypyrimidine-2,4-dione Traditional Name: 1-cyclohexyl-6-hydroxy-5-[(1S)-3-keto-4,5-dimethoxy-phthalan-1-yl]pyrimidine-2,4-quinone Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(N(C(=O)NC3=O)C4CCCCC4)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@H](OC2=O)C3=C(N(C(=O)NC3=O)C4CCCCC4)O)OC

InChI

InChI=1S/C20H22N2O7/c1-27-12-9-8-11-13(16(12)28-2)19(25)29-15(11)14-17(23)21-20(26)22(18(14)24)10-6-4-3-5-7-10/h8-10,15,24H,3-7H2,1-2H3,(H,21,23,26)/t15-/m0/s1