(4Z)-6-iodanyl-4-[[(3-oxidanyl-4-phenyl-phenyl)methylamino]methylidene]isoquinoline-1,3-dione

Systemtic Name: (4Z)-6-iodanyl-4-[[(3-oxidanyl-4-phenyl-phenyl)methylamino]methylidene]isoquinoline-1,3-dione Openeye Name: (4Z)-4-[[(3-hydroxy-4-phenyl-phenyl)methylamino]methylene]-6-iodo-isoquinoline-1,3-dione CAS Name: (4Z)-4-[[(3-hydroxy-4-phenylphenyl)methylamino]methylidene]-6-iodoisoquinoline-1,3-dione IUPAC Name: (4Z)-4-[[(3-hydroxy-4-phenylphenyl)methylamino]methylidene]-6-iodoisoquinoline-1,3-dione Traditional Name: (4Z)-4-[[(3-hydroxy-4-phenyl-benzyl)amino]methylene]-6-iodo-isoquinoline-1,3-quinone Formula: C23H17IN2O3 MolecularWeight: 496.29715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CNC=C3C4=C(C=CC(=C4)I)C(=O)NC3=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CN/C=C\3/C4=C(C=CC(=C4)I)C(=O)NC3=O)O

InChI

InChI=1S/C23H17IN2O3/c24-16-7-9-18-19(11-16)20(23(29)26-22(18)28)13-25-12-14-6-8-17(21(27)10-14)15-4-2-1-3-5-15/h1-11,13,25,27H,12H2,(H,26,28,29)/b20-13-