3-[2-(4-tert-butyl-2,6-dimethyl-phenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-ynyl-indol-2-one

Systemtic Name: 3-[2-(4-tert-butyl-2,6-dimethyl-phenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-ynyl-indol-2-one Openeye Name: 3-[2-(4-tert-butyl-2,6-dimethyl-phenyl)-2-oxo-ethyl]-3-hydroxy-1-prop-2-ynyl-indolin-2-one CAS Name: 3-[2-(4-tert-butyl-2,6-dimethylphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-ynyl-2-indolone IUPAC Name: 3-[2-(4-tert-butyl-2,6-dimethylphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-ynylindol-2-one Traditional Name: 3-[2-(4-tert-butyl-2,6-dimethyl-phenyl)-2-keto-ethyl]-3-hydroxy-1-propargyl-oxindole Formula: C25H27NO3 MolecularWeight: 389.48678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)CC2(C3=CC=CC=C3N(C2=O)CC#C)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)CC2(C3=CC=CC=C3N(C2=O)CC#C)O)C)C(C)(C)C

InChI

InChI=1S/C25H27NO3/c1-7-12-26-20-11-9-8-10-19(20)25(29,23(26)28)15-21(27)22-16(2)13-18(14-17(22)3)24(4,5)6/h1,8-11,13-14,29H,12,15H2,2-6H3