5-bromanyl-3-oxidanyl-3-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]-1-prop-2-ynyl-indol-2-one

Systemtic Name: 5-bromanyl-3-oxidanyl-3-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]-1-prop-2-ynyl-indol-2-one Openeye Name: 5-bromo-3-hydroxy-3-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-prop-2-ynyl-indolin-2-one CAS Name: 5-bromo-3-hydroxy-3-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-prop-2-ynyl-2-indolone IUPAC Name: 5-bromo-3-hydroxy-3-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-prop-2-ynylindol-2-one Traditional Name: 5-bromo-3-hydroxy-3-[2-keto-2-(2,4,5-trimethylphenyl)ethyl]-1-propargyl-oxindole Formula: C22H20BrNO3 MolecularWeight: 426.3031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O)C)C

InChI

InChI=1S/C22H20BrNO3/c1-5-8-24-19-7-6-16(23)11-18(19)22(27,21(24)26)12-20(25)17-10-14(3)13(2)9-15(17)4/h1,6-7,9-11,27H,8,12H2,2-4H3