[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [(1S)-2-indolin-1-yl-1-methyl-2-oxo-ethyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [(1S)-2-indolin-1-yl-2-keto-1-methyl-ethyl] ester Formula: C19H18BrNO4 MolecularWeight: 404.25452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=C(C=CC(=C3)OC)Br

Isomeric SMILES

C[C@@H](C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C19H18BrNO4/c1-12(18(22)21-10-9-13-5-3-4-6-17(13)21)25-19(23)15-11-14(24-2)7-8-16(15)20/h3-8,11-12H,9-10H2,1-2H3/t12-/m0/s1