tert-butyl (3R)-3-[(4-bromophenyl)methyl]-3-oxidanyl-2-oxidanylidene-indole-1-carboxylate

Systemtic Name: tert-butyl (3R)-3-[(4-bromophenyl)methyl]-3-oxidanyl-2-oxidanylidene-indole-1-carboxylate Openeye Name: tert-butyl (3R)-3-[(4-bromophenyl)methyl]-3-hydroxy-2-oxo-indoline-1-carboxylate CAS Name: (3R)-3-[(4-bromophenyl)methyl]-3-hydroxy-2-oxo-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[(4-bromophenyl)methyl]-3-hydroxy-2-oxoindole-1-carboxylate Traditional Name: (3R)-3-(4-bromobenzyl)-3-hydroxy-2-keto-indoline-1-carboxylic acid tert-butyl ester Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2C(C1=O)(CC3=CC=C(C=C3)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2[C@@](C1=O)(CC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C20H20BrNO4/c1-19(2,3)26-18(24)22-16-7-5-4-6-15(16)20(25,17(22)23)12-13-8-10-14(21)11-9-13/h4-11,25H,12H2,1-3H3/t20-/m1/s1