4-bromanyl-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[(3,5,7-trimethyl-1-adamantyl)methylamino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H28BrNO MolecularWeight: 390.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3(CC(C1)(CC(C2)(C3)CNC=C4C=C(C=CC4=O)Br)C)C

Isomeric SMILES

CC12CC3(CC(C1)(CC(C2)(C3)CNC=C4C=C(C=CC4=O)Br)C)C

InChI

InChI=1S/C21H28BrNO/c1-18-8-19(2)10-20(3,9-18)13-21(11-18,12-19)14-23-7-15-6-16(22)4-5-17(15)24/h4-7,23H,8-14H2,1-3H3