4-bromanyl-6-[[[2-methyl-5-(3-oxidanyl-1-adamantyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[[2-methyl-5-(3-oxidanyl-1-adamantyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[5-(3-hydroxy-1-adamantyl)-2-methyl-anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[5-(3-hydroxy-1-adamantyl)-2-methylanilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[5-(3-hydroxy-1-adamantyl)-2-methylanilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[5-(3-hydroxy-1-adamantyl)-2-methyl-anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C24H26BrNO2 MolecularWeight: 440.37274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)O)NC=C5C=C(C=CC5=O)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)O)NC=C5C=C(C=CC5=O)Br

InChI

InChI=1S/C24H26BrNO2/c1-15-2-3-19(8-21(15)26-13-18-7-20(25)4-5-22(18)27)23-9-16-6-17(10-23)12-24(28,11-16)14-23/h2-5,7-8,13,16-17,26,28H,6,9-12,14H2,1H3