6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]-4-chloranyl-2-iodanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]-4-chloranyl-2-iodanyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylene]-4-chloro-2-iodo-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]-4-chloro-2-iodo-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylidene]-4-chloro-2-iodocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-6-yl]amino]methylene]-4-chloro-2-iodo-cyclohexa-2,4-dien-1-one Formula: C24H20ClIN2O2 MolecularWeight: 530.78527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)NC=C4C=C(C=C(C4=O)I)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)NC=C4C=C(C=C(C4=O)I)Cl

InChI

InChI=1S/C24H20ClIN2O2/c1-24(2,3)16-6-4-14(5-7-16)23-28-20-9-8-18(12-21(20)30-23)27-13-15-10-17(25)11-19(26)22(15)29/h4-13,27H,1-3H3