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

Systemtic Name: 1-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-(phenylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 2-benzyl-1-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 1-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(phenylmethyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 2-benzyl-1-(3-bromo-4-hydroxy-5-methoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 2-benzyl-1-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C25H18BrNO5 MolecularWeight: 492.31812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C(=O)N2CC4=CC=CC=C4)OC5=CC=CC=C5C3=O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C(=O)N2CC4=CC=CC=C4)OC5=CC=CC=C5C3=O)Br)O

InChI

InChI=1S/C25H18BrNO5/c1-31-19-12-15(11-17(26)23(19)29)21-20-22(28)16-9-5-6-10-18(16)32-24(20)25(30)27(21)13-14-7-3-2-4-8-14/h2-12,21,29H,13H2,1H3