(4Z)-4-[[[4-(1-adamantyl)phenyl]amino]methylidene]-2-iodanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[[[4-(1-adamantyl)phenyl]amino]methylidene]-2-iodanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-[[4-(1-adamantyl)anilino]methylene]-2-iodo-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[[4-(1-adamantyl)anilino]methylidene]-2-iodo-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-[[4-(1-adamantyl)anilino]methylidene]-2-iodocyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[[4-(1-adamantyl)anilino]methylene]-2-iodo-cyclohexa-2,5-dien-1-one Formula: C23H24INO MolecularWeight: 457.34723

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC=C5C=CC(=O)C(=C5)I

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)N/C=C\5/C=CC(=O)C(=C5)I

InChI

InChI=1S/C23H24INO/c24-21-10-15(1-6-22(21)26)14-25-20-4-2-19(3-5-20)23-11-16-7-17(12-23)9-18(8-16)13-23/h1-6,10,14,16-18,25H,7-9,11-13H2/b15-14-