2-methylpropoxycarbonyl (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: 2-methylpropoxycarbonyl (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: isobutoxycarbonyl (2S)-2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid [2-methylpropoxy(oxo)methyl] ester IUPAC Name: 2-methylpropoxycarbonyl (2S)-3-(4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid isobutoxycarbonyl ester Formula: C22H25NO7 MolecularWeight: 415.4364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)OC(=O)C(CC1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)OC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO7/c1-15(2)13-29-22(27)30-20(25)19(12-16-8-10-18(24)11-9-16)23-21(26)28-14-17-6-4-3-5-7-17/h3-11,15,19,24H,12-14H2,1-2H3,(H,23,26)/t19-/m0/s1