tert-butyl (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(E)-4-(2-bromophenyl)but-3-enyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C20H28BrNO3 MolecularWeight: 410.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(CO1)CCC=CC2=CC=CC=C2Br)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(N([C@H](CO1)CC/C=C/C2=CC=CC=C2Br)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C20H28BrNO3/c1-19(2,3)25-18(23)22-16(14-24-20(22,4)5)12-8-6-10-15-11-7-9-13-17(15)21/h6-7,9-11,13,16H,8,12,14H2,1-5H3/b10-6+/t16-/m0/s1