(3S)-5-bromanyl-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(phenylmethyl)indol-2-one

Systemtic Name: (3S)-5-bromanyl-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(phenylmethyl)indol-2-one Openeye Name: (3S)-1-benzyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-3-hydroxy-indolin-2-one CAS Name: (3S)-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(phenylmethyl)-2-indolone IUPAC Name: (3S)-1-benzyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxyindol-2-one Traditional Name: (3S)-1-benzyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-3-hydroxy-oxindole Formula: C25H22BrNO5 MolecularWeight: 496.34988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C[C@@]2(C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)O)OC

InChI

InChI=1S/C25H22BrNO5/c1-31-22-11-8-17(12-23(22)32-2)21(28)14-25(30)19-13-18(26)9-10-20(19)27(24(25)29)15-16-6-4-3-5-7-16/h3-13,30H,14-15H2,1-2H3/t25-/m0/s1