tert-butyl (2R,3S)-1-(phenylmethyl)-3-[(E)-1-phenylprop-1-en-2-yl]aziridine-2-carboxylate

Systemtic Name: tert-butyl (2R,3S)-1-(phenylmethyl)-3-[(E)-1-phenylprop-1-en-2-yl]aziridine-2-carboxylate Openeye Name: tert-butyl (2R,3S)-1-benzyl-3-[(E)-1-methyl-2-phenyl-vinyl]aziridine-2-carboxylate CAS Name: (2R,3S)-1-(phenylmethyl)-3-[(E)-1-phenylprop-1-en-2-yl]-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-1-benzyl-3-[(E)-1-phenylprop-1-en-2-yl]aziridine-2-carboxylate Traditional Name: (2R,3S)-1-benzyl-3-[(E)-1-methyl-2-phenyl-vinyl]ethylenimine-2-carboxylic acid tert-butyl ester Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C2C(N2CC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/[C@H]2[C@@H](N2CC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H27NO2/c1-17(15-18-11-7-5-8-12-18)20-21(22(25)26-23(2,3)4)24(20)16-19-13-9-6-10-14-19/h5-15,20-21H,16H2,1-4H3/b17-15+/t20-,21+,24?/m0/s1