(phenylmethyl) (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanyl-butanoate

Systemtic Name: (phenylmethyl) (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanyl-butanoate Openeye Name: benzyl (2S,3S)-2-(tert-butoxycarbonylamino)-3-phenylselanyl-butanoate CAS Name: (2S,3S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(phenylseleno)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanylbutanoate Traditional Name: (2S,3S)-2-(tert-butoxycarbonylamino)-3-(phenylseleno)butyric acid benzyl ester Formula: C22H27NO4Se MolecularWeight: 448.41408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C)[Se]C2=CC=CC=C2

Isomeric SMILES

C[C@@H]([C@H](C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C)[Se]C2=CC=CC=C2

InChI

InChI=1S/C22H27NO4Se/c1-16(28-18-13-9-6-10-14-18)19(23-21(25)27-22(2,3)4)20(24)26-15-17-11-7-5-8-12-17/h5-14,16,19H,15H2,1-4H3,(H,23,25)/t16-,19+/m0/s1