N-[(5R)-3,5-ditert-butyl-5,6,6-tris(chloranyl)-4-oxidanylidene-cyclohex-2-en-1-ylidene]-4-methyl-benzamide

Systemtic Name: N-[(5R)-3,5-ditert-butyl-5,6,6-tris(chloranyl)-4-oxidanylidene-cyclohex-2-en-1-ylidene]-4-methyl-benzamide Openeye Name: N-[(5R)-3,5-ditert-butyl-5,6,6-trichloro-4-oxo-cyclohex-2-en-1-ylidene]-4-methyl-benzamide CAS Name: N-[(5R)-3,5-ditert-butyl-5,6,6-trichloro-4-oxo-1-cyclohex-2-enylidene]-4-methylbenzamide IUPAC Name: N-[(5R)-3,5-ditert-butyl-5,6,6-trichloro-4-oxocyclohex-2-en-1-ylidene]-4-methylbenzamide Traditional Name: N-[(5R)-3,5-ditert-butyl-5,6,6-trichloro-4-keto-cyclohex-2-en-1-ylidene]-4-methyl-benzamide Formula: C22H26Cl3NO2 MolecularWeight: 442.80634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N=C2C=C(C(=O)C(C2(Cl)Cl)(C(C)(C)C)Cl)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N=C2C=C(C(=O)[C@@](C2(Cl)Cl)(C(C)(C)C)Cl)C(C)(C)C

InChI

InChI=1S/C22H26Cl3NO2/c1-13-8-10-14(11-9-13)18(28)26-16-12-15(19(2,3)4)17(27)21(23,20(5,6)7)22(16,24)25/h8-12H,1-7H3/t21-/m0/s1