3-azanyl-4,4,4-tris(chloranyl)-1-(5-methyl-2-oxidanyl-phenyl)but-2-en-1-one

Systemtic Name: 3-azanyl-4,4,4-tris(chloranyl)-1-(5-methyl-2-oxidanyl-phenyl)but-2-en-1-one Openeye Name: 3-amino-4,4,4-trichloro-1-(2-hydroxy-5-methyl-phenyl)but-2-en-1-one CAS Name: 3-amino-4,4,4-trichloro-1-(2-hydroxy-5-methylphenyl)-2-buten-1-one IUPAC Name: 3-amino-4,4,4-trichloro-1-(2-hydroxy-5-methylphenyl)but-2-en-1-one Traditional Name: 3-amino-4,4,4-trichloro-1-(2-hydroxy-5-methyl-phenyl)but-2-en-1-one Formula: C11H10Cl3NO2 MolecularWeight: 294.5616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10Cl3NO2/c1-6-2-3-8(16)7(4-6)9(17)5-10(15)11(12,13)14/h2-5,16H,15H2,1H3