2,4-ditert-butyl-6-[(4-chloranyl-2-nitro-phenyl)diazenyl]-4-methyl-cyclohexa-2,5-dien-1-ol

Systemtic Name: 2,4-ditert-butyl-6-[(4-chloranyl-2-nitro-phenyl)diazenyl]-4-methyl-cyclohexa-2,5-dien-1-ol Openeye Name: 2,4-ditert-butyl-6-(4-chloro-2-nitro-phenyl)azo-4-methyl-cyclohexa-2,5-dien-1-ol CAS Name: 2,4-ditert-butyl-6-(4-chloro-2-nitrophenyl)azo-4-methyl-1-cyclohexa-2,5-dienol IUPAC Name: 2,4-ditert-butyl-6-[(4-chloro-2-nitrophenyl)diazenyl]-4-methylcyclohexa-2,5-dien-1-ol Traditional Name: 2,4-ditert-butyl-6-(4-chloro-2-nitro-phenyl)azo-4-methyl-cyclohexa-2,5-dien-1-ol Formula: C21H28ClN3O3 MolecularWeight: 405.91832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C(C(=C1)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1(C=C(C(C(=C1)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C21H28ClN3O3/c1-19(2,3)14-11-21(7,20(4,5)6)12-16(18(14)26)24-23-15-9-8-13(22)10-17(15)25(27)28/h8-12,18,26H,1-7H3