(3S)-5-bromanyl-3-oxidanyl-3-[2-oxidanylidene-2-(4-pyrrol-1-ylphenyl)ethyl]-1-phenethyl-indol-2-one

Systemtic Name: (3S)-5-bromanyl-3-oxidanyl-3-[2-oxidanylidene-2-(4-pyrrol-1-ylphenyl)ethyl]-1-phenethyl-indol-2-one Openeye Name: (3S)-5-bromo-3-hydroxy-3-[2-oxo-2-(4-pyrrol-1-ylphenyl)ethyl]-1-phenethyl-indolin-2-one CAS Name: (3S)-5-bromo-3-hydroxy-3-[2-oxo-2-[4-(1-pyrrolyl)phenyl]ethyl]-1-phenethyl-2-indolone IUPAC Name: (3S)-5-bromo-3-hydroxy-3-[2-oxo-2-(4-pyrrol-1-ylphenyl)ethyl]-1-phenethylindol-2-one Traditional Name: (3S)-5-bromo-3-hydroxy-3-[2-keto-2-(4-pyrrol-1-ylphenyl)ethyl]-1-phenethyl-oxindole Formula: C28H23BrN2O3 MolecularWeight: 515.39782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)Br)C(C2=O)(CC(=O)C4=CC=C(C=C4)N5C=CC=C5)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)Br)[C@](C2=O)(CC(=O)C4=CC=C(C=C4)N5C=CC=C5)O

InChI

InChI=1S/C28H23BrN2O3/c29-22-10-13-25-24(18-22)28(34,27(33)31(25)17-14-20-6-2-1-3-7-20)19-26(32)21-8-11-23(12-9-21)30-15-4-5-16-30/h1-13,15-16,18,34H,14,17,19H2/t28-/m0/s1