tert-butyl (3S,4S)-4-phenyl-3-[[1-(phenylsulfonyl)indol-3-yl]methyl]-1,2-oxazolidine-2-carboxylate

Systemtic Name: tert-butyl (3S,4S)-4-phenyl-3-[[1-(phenylsulfonyl)indol-3-yl]methyl]-1,2-oxazolidine-2-carboxylate Openeye Name: tert-butyl (3S,4S)-3-[[1-(benzenesulfonyl)indol-3-yl]methyl]-4-phenyl-isoxazolidine-2-carboxylate CAS Name: (3S,4S)-3-[[1-(benzenesulfonyl)-3-indolyl]methyl]-4-phenyl-2-isoxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-3-[[1-(benzenesulfonyl)indol-3-yl]methyl]-4-phenyl-1,2-oxazolidine-2-carboxylate Traditional Name: (3S,4S)-3-[(1-besylindol-3-yl)methyl]-4-phenyl-isoxazolidine-2-carboxylic acid tert-butyl ester Formula: C29H30N2O5S MolecularWeight: 518.6239

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(CO1)C2=CC=CC=C2)CC3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H]([C@@H](CO1)C2=CC=CC=C2)CC3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H30N2O5S/c1-29(2,3)36-28(32)31-27(25(20-35-31)21-12-6-4-7-13-21)18-22-19-30(26-17-11-10-16-24(22)26)37(33,34)23-14-8-5-9-15-23/h4-17,19,25,27H,18,20H2,1-3H3/t25-,27-/m0/s1