tert-butyl (2R,3S)-3-ethyl-2-methyl-2-[(E)-3-phenylmethoxyprop-1-enyl]aziridine-1-carboxylate

Systemtic Name: tert-butyl (2R,3S)-3-ethyl-2-methyl-2-[(E)-3-phenylmethoxyprop-1-enyl]aziridine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-2-[(E)-3-benzyloxyprop-1-enyl]-3-ethyl-2-methyl-aziridine-1-carboxylate CAS Name: (2R,3S)-3-ethyl-2-methyl-2-[(E)-3-phenylmethoxyprop-1-enyl]-1-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-ethyl-2-methyl-2-[(E)-3-phenylmethoxyprop-1-enyl]aziridine-1-carboxylate Traditional Name: (2R,3S)-2-[(E)-3-benzoxyprop-1-enyl]-3-ethyl-2-methyl-ethylenimine-1-carboxylic acid tert-butyl ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N1C(=O)OC(C)(C)C)(C)C=CCOCC2=CC=CC=C2

Isomeric SMILES

CC[C@H]1[C@@](N1C(=O)OC(C)(C)C)(C)/C=C/COCC2=CC=CC=C2

InChI

InChI=1S/C20H29NO3/c1-6-17-20(5,21(17)18(22)24-19(2,3)4)13-10-14-23-15-16-11-8-7-9-12-16/h7-13,17H,6,14-15H2,1-5H3/b13-10+/t17-,20+,21?/m0/s1