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

Systemtic Name: 4-bromanyl-6-[[(3,5-dimethyl-1-adamantyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[(3,5-dimethyl-1-adamantyl)methylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[(3,5-dimethyl-1-adamantyl)methylamino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[(3,5-dimethyl-1-adamantyl)methylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[(3,5-dimethyl-1-adamantyl)methylamino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H26BrNO MolecularWeight: 376.33054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)CNC=C4C=C(C=CC4=O)Br)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)CNC=C4C=C(C=CC4=O)Br)C

InChI

InChI=1S/C20H26BrNO/c1-18-6-14-7-19(2,10-18)12-20(8-14,11-18)13-22-9-15-5-16(21)3-4-17(15)23/h3-5,9,14,22H,6-8,10-13H2,1-2H3