tert-butyl (E,3S)-3-[[(1R)-1-phenylethyl]-phenylmethoxycarbonyl-amino]hex-4-enoate

Systemtic Name: tert-butyl (E,3S)-3-[[(1R)-1-phenylethyl]-phenylmethoxycarbonyl-amino]hex-4-enoate Openeye Name: tert-butyl (E,3S)-3-[benzyloxycarbonyl-[(1R)-1-phenylethyl]amino]hex-4-enoate CAS Name: (E,3S)-3-[[(1R)-1-phenylethyl]-phenylmethoxycarbonylamino]-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,3S)-3-[[(1R)-1-phenylethyl]-phenylmethoxycarbonylamino]hex-4-enoate Traditional Name: (E,3S)-3-[carbobenzoxy-[(1R)-1-phenylethyl]amino]hex-4-enoic acid tert-butyl ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(CC(=O)OC(C)(C)C)N(C(C)C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C/C=C/[C@H](CC(=O)OC(C)(C)C)N([C@H](C)C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33NO4/c1-6-13-23(18-24(28)31-26(3,4)5)27(20(2)22-16-11-8-12-17-22)25(29)30-19-21-14-9-7-10-15-21/h6-17,20,23H,18-19H2,1-5H3/b13-6+/t20-,23-/m1/s1