(diphenylmethyl) (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (diphenylmethyl) (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: benzhydryl (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid benzhydryl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29NO5/c1-27(2,3)33-26(31)28-23(18-19-14-16-22(29)17-15-19)25(30)32-24(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-17,23-24,29H,18H2,1-3H3,(H,28,31)/t23-/m0/s1