(phenylmethyl) 3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: benzyl 3-(4-benzyloxy-2,6-dimethyl-phenyl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: 3-(2,6-dimethyl-4-phenylmethoxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(2,6-dimethyl-4-phenylmethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(4-benzoxy-2,6-dimethyl-phenyl)-2-(tert-butoxycarbonylamino)propionic acid benzyl ester Formula: C30H35NO5 MolecularWeight: 489.6026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1CC(C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C30H35NO5/c1-21-16-25(34-19-23-12-8-6-9-13-23)17-22(2)26(21)18-27(31-29(33)36-30(3,4)5)28(32)35-20-24-14-10-7-11-15-24/h6-17,27H,18-20H2,1-5H3,(H,31,33)