(6Z)-6-[(2-adamantylamino)methylidene]-4-methyl-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[(2-adamantylamino)methylidene]-4-methyl-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[(2-adamantylamino)methylene]-4-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[(2-adamantylamino)methylidene]-4-methyl-2-(2-phenylpropan-2-yl)-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[(2-adamantylamino)methylidene]-4-methyl-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[(2-adamantylamino)methylene]-2-cumyl-4-methyl-cyclohexa-2,4-dien-1-one Formula: C27H33NO MolecularWeight: 387.55702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2C3CC4CC(C3)CC2C4)C(=O)C(=C1)C(C)(C)C5=CC=CC=C5

Isomeric SMILES

CC1=C/C(=C/NC2C3CC4CC(C3)CC2C4)/C(=O)C(=C1)C(C)(C)C5=CC=CC=C5

InChI

InChI=1S/C27H33NO/c1-17-9-22(16-28-25-20-12-18-11-19(14-20)15-21(25)13-18)26(29)24(10-17)27(2,3)23-7-5-4-6-8-23/h4-10,16,18-21,25,28H,11-15H2,1-3H3/b22-16-