5-bromanyl-3-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-phenethyl-indol-2-one

Systemtic Name: 5-bromanyl-3-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-phenethyl-indol-2-one Openeye Name: 5-bromo-3-[2-(4-tert-butylphenyl)-2-oxo-ethyl]-3-hydroxy-1-phenethyl-indolin-2-one CAS Name: 5-bromo-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-hydroxy-1-phenethyl-2-indolone IUPAC Name: 5-bromo-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-hydroxy-1-phenethylindol-2-one Traditional Name: 5-bromo-3-[2-(4-tert-butylphenyl)-2-keto-ethyl]-3-hydroxy-1-phenethyl-oxindole Formula: C28H28BrNO3 MolecularWeight: 506.43082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CCC4=CC=CC=C4)O

InChI

InChI=1S/C28H28BrNO3/c1-27(2,3)21-11-9-20(10-12-21)25(31)18-28(33)23-17-22(29)13-14-24(23)30(26(28)32)16-15-19-7-5-4-6-8-19/h4-14,17,33H,15-16,18H2,1-3H3