(2-octoxy-2-oxidanylidene-ethyl) 2-methyl-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoate

Systemtic Name: (2-octoxy-2-oxidanylidene-ethyl) 2-methyl-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoate Openeye Name: (2-octoxy-2-oxo-ethyl) 2-(benzyloxycarbonylamino)-3-(4-benzyloxycarbonyloxyphenyl)-2-methyl-propanoate CAS Name: 2-methyl-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoic acid (2-octoxy-2-oxoethyl) ester IUPAC Name: (2-octoxy-2-oxoethyl) 2-methyl-2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxycarbonyloxyphenyl)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(4-carbobenzoxyoxyphenyl)-2-methyl-propionic acid (2-keto-2-octoxy-ethyl) ester Formula: C36H43NO9 MolecularWeight: 633.72792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)COC(=O)C(C)(CC1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC(=O)COC(=O)C(C)(CC1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C36H43NO9/c1-3-4-5-6-7-14-23-42-32(38)27-43-33(39)36(2,37-34(40)44-25-29-15-10-8-11-16-29)24-28-19-21-31(22-20-28)46-35(41)45-26-30-17-12-9-13-18-30/h8-13,15-22H,3-7,14,23-27H2,1-2H3,(H,37,40)