4-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-3-methyl-5-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-3-methyl-5-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 3-hydroxy-4-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-5-methyl-cyclohexa-2,5-dien-1-one CAS Name: 3-hydroxy-4-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-5-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 3-hydroxy-4-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-5-methylcyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-5-methyl-cyclohexa-2,5-dien-1-one Formula: C21H15IN2O3 MolecularWeight: 470.25987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=C(C1=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)O

Isomeric SMILES

CC1=CC(=O)C=C(C1=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)O

InChI

InChI=1S/C21H15IN2O3/c1-12-7-16(25)10-19(26)17(12)11-23-15-5-6-20-18(9-15)24-21(27-20)13-3-2-4-14(22)8-13/h2-11,23,26H,1H3