[4-acetyloxy-3-[2,6-bis(chloranyl)phenyl]-7-tert-butyl-1,2-benzoxazol-5-yl] ethanoate

Systemtic Name: [4-acetyloxy-3-[2,6-bis(chloranyl)phenyl]-7-tert-butyl-1,2-benzoxazol-5-yl] ethanoate Openeye Name: [4-acetoxy-7-tert-butyl-3-(2,6-dichlorophenyl)-1,2-benzoxazol-5-yl] acetate CAS Name: acetic acid [4-acetyloxy-7-tert-butyl-3-(2,6-dichlorophenyl)-1,2-benzoxazol-5-yl] ester IUPAC Name: [4-acetyloxy-7-tert-butyl-3-(2,6-dichlorophenyl)-1,2-benzoxazol-5-yl] acetate Traditional Name: acetic acid [4-acetoxy-7-tert-butyl-3-(2,6-dichlorophenyl)indoxazen-5-yl] ester Formula: C21H19Cl2NO5 MolecularWeight: 436.28526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C2=C(C(=C1)C(C)(C)C)ON=C2C3=C(C=CC=C3Cl)Cl)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C2=C(C(=C1)C(C)(C)C)ON=C2C3=C(C=CC=C3Cl)Cl)OC(=O)C

InChI

InChI=1S/C21H19Cl2NO5/c1-10(25)27-15-9-12(21(3,4)5)19-17(20(15)28-11(2)26)18(24-29-19)16-13(22)7-6-8-14(16)23/h6-9H,1-5H3