O1-ethyl O3-(4-phenylmethoxyphenyl) 2-butyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanedioate

Systemtic Name: O1-ethyl O3-(4-phenylmethoxyphenyl) 2-butyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanedioate Openeye Name: O1-(4-benzyloxyphenyl) O3-ethyl 2-(tert-butoxycarbonylamino)-2-butyl-propanedioate CAS Name: 2-butyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanedioic acid O1-ethyl ester O3-(4-phenylmethoxyphenyl) ester IUPAC Name: 1-O-ethyl 3-O-(4-phenylmethoxyphenyl) 2-butyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanedioate Traditional Name: 2-(tert-butoxycarbonylamino)-2-butyl-malonic acid O1-(4-benzoxyphenyl) ester O3-ethyl ester Formula: C27H35NO7 MolecularWeight: 485.5693

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)(C(=O)OC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)OCC)(C(=O)OC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H35NO7/c1-6-8-18-27(23(29)32-7-2,28-25(31)35-26(3,4)5)24(30)34-22-16-14-21(15-17-22)33-19-20-12-10-9-11-13-20/h9-17H,6-8,18-19H2,1-5H3,(H,28,31)