(6E)-3-bromanyl-6-[[[4-(3-oxidanyl-1-adamantyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-3-bromanyl-6-[[[4-(3-oxidanyl-1-adamantyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-3-bromo-6-[[4-(3-hydroxy-1-adamantyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-3-bromo-6-[[4-(3-hydroxy-1-adamantyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-3-bromo-6-[[4-(3-hydroxy-1-adamantyl)anilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-3-bromo-6-[[4-(3-hydroxy-1-adamantyl)anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C23H24BrNO2 MolecularWeight: 426.34616

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C4=CC=C(C=C4)NC=C5C=CC(=CC5=O)Br

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)C4=CC=C(C=C4)N/C=C/5\C=CC(=CC5=O)Br

InChI

InChI=1S/C23H24BrNO2/c24-19-4-1-17(21(26)8-19)13-25-20-5-2-18(3-6-20)22-9-15-7-16(10-22)12-23(27,11-15)14-22/h1-6,8,13,15-16,25,27H,7,9-12,14H2/b17-13+