(6E)-2-iodanyl-6-[[(2-pyridin-4-yl-1,3-benzoxazol-6-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-iodanyl-6-[[(2-pyridin-4-yl-1,3-benzoxazol-6-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-iodo-6-[[[2-(4-pyridyl)-1,3-benzoxazol-6-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-iodo-6-[[(2-pyridin-4-yl-1,3-benzoxazol-6-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-iodo-6-[[(2-pyridin-4-yl-1,3-benzoxazol-6-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-iodo-6-[[[2-(4-pyridyl)-1,3-benzoxazol-6-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C19H12IN3O2 MolecularWeight: 441.22195

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNC2=CC3=C(C=C2)N=C(O3)C4=CC=NC=C4)C(=O)C(=C1)I

Isomeric SMILES

C1=C/C(=C\NC2=CC3=C(C=C2)N=C(O3)C4=CC=NC=C4)/C(=O)C(=C1)I

InChI

InChI=1S/C19H12IN3O2/c20-15-3-1-2-13(18(15)24)11-22-14-4-5-16-17(10-14)25-19(23-16)12-6-8-21-9-7-12/h1-11,22H/b13-11+