1-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-7-fluoranyl-2-pyrimidin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 1-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-7-fluoranyl-2-pyrimidin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 1-(3-bromo-4-hydroxy-5-methoxy-phenyl)-7-fluoro-2-pyrimidin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 1-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-fluoro-2-(2-pyrimidinyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 1-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-fluoro-2-pyrimidin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 1-(3-bromo-4-hydroxy-5-methoxy-phenyl)-7-fluoro-2-(2-pyrimidyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C22H13BrFN3O5 MolecularWeight: 498.258123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C(=O)N2C4=NC=CC=N4)OC5=C(C3=O)C=C(C=C5)F)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C(=O)N2C4=NC=CC=N4)OC5=C(C3=O)C=C(C=C5)F)Br)O

InChI

InChI=1S/C22H13BrFN3O5/c1-31-15-8-10(7-13(23)19(15)29)17-16-18(28)12-9-11(24)3-4-14(12)32-20(16)21(30)27(17)22-25-5-2-6-26-22/h2-9,17,29H,1H3