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

Systemtic Name: (6Z)-4-bromanyl-6-[[[4-(3-phenyl-1-adamantyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-bromo-6-[[4-(3-phenyl-1-adamantyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-bromo-6-[[4-(3-phenyl-1-adamantyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-bromo-6-[[4-(3-phenyl-1-adamantyl)anilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-bromo-6-[[4-(3-phenyl-1-adamantyl)anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C29H28BrNO MolecularWeight: 486.44272

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C4=CC=C(C=C4)NC=C5C=C(C=CC5=O)Br)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C4=CC=C(C=C4)N/C=C\5/C=C(C=CC5=O)Br)C6=CC=CC=C6

InChI

InChI=1S/C29H28BrNO/c30-25-8-11-27(32)22(13-25)18-31-26-9-6-24(7-10-26)29-16-20-12-21(17-29)15-28(14-20,19-29)23-4-2-1-3-5-23/h1-11,13,18,20-21,31H,12,14-17,19H2/b22-18-