tert-butyl (2R,3R)-3-[(Z)-1-bromanyl-2-phenyl-ethenyl]-1-(phenylmethyl)aziridine-2-carboxylate

Systemtic Name: tert-butyl (2R,3R)-3-[(Z)-1-bromanyl-2-phenyl-ethenyl]-1-(phenylmethyl)aziridine-2-carboxylate Openeye Name: tert-butyl (2R,3R)-1-benzyl-3-[(Z)-1-bromo-2-phenyl-vinyl]aziridine-2-carboxylate CAS Name: (2R,3R)-3-[(Z)-1-bromo-2-phenylethenyl]-1-(phenylmethyl)-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R)-1-benzyl-3-[(Z)-1-bromo-2-phenylethenyl]aziridine-2-carboxylate Traditional Name: (2R,3R)-1-benzyl-3-[(Z)-1-bromo-2-phenyl-vinyl]ethylenimine-2-carboxylic acid tert-butyl ester Formula: C22H24BrNO2 MolecularWeight: 414.33546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(N1CC2=CC=CC=C2)C(=CC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1[C@@H](N1CC2=CC=CC=C2)/C(=C/C3=CC=CC=C3)/Br

InChI

InChI=1S/C22H24BrNO2/c1-22(2,3)26-21(25)20-19(18(23)14-16-10-6-4-7-11-16)24(20)15-17-12-8-5-9-13-17/h4-14,19-20H,15H2,1-3H3/b18-14-/t19-,20+,24?/m0/s1