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

Systemtic Name: (4Z)-6-iodanyl-4-[[(4-methoxy-3-oxidanyl-phenyl)methylamino]methylidene]isoquinoline-1,3-dione Openeye Name: (4Z)-4-[[(3-hydroxy-4-methoxy-phenyl)methylamino]methylene]-6-iodo-isoquinoline-1,3-dione CAS Name: (4Z)-4-[[(3-hydroxy-4-methoxyphenyl)methylamino]methylidene]-6-iodoisoquinoline-1,3-dione IUPAC Name: (4Z)-4-[[(3-hydroxy-4-methoxyphenyl)methylamino]methylidene]-6-iodoisoquinoline-1,3-dione Traditional Name: (4Z)-4-[[(3-hydroxy-4-methoxy-benzyl)amino]methylene]-6-iodo-isoquinoline-1,3-quinone Formula: C18H15IN2O4 MolecularWeight: 450.22717

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC=C2C3=C(C=CC(=C3)I)C(=O)NC2=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN/C=C\2/C3=C(C=CC(=C3)I)C(=O)NC2=O)O

InChI

InChI=1S/C18H15IN2O4/c1-25-16-5-2-10(6-15(16)22)8-20-9-14-13-7-11(19)3-4-12(13)17(23)21-18(14)24/h2-7,9,20,22H,8H2,1H3,(H,21,23,24)/b14-9-