diethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[4-(2-phenylmethoxyphenyl)butyl]propanedioate

Systemtic Name: diethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[4-(2-phenylmethoxyphenyl)butyl]propanedioate Openeye Name: diethyl 2-[4-(2-benzyloxyphenyl)butyl]-2-(tert-butoxycarbonylamino)propanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[4-(2-phenylmethoxyphenyl)butyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[4-(2-phenylmethoxyphenyl)butyl]propanedioate Traditional Name: 2-[4-(2-benzoxyphenyl)butyl]-2-(tert-butoxycarbonylamino)malonic acid diethyl ester Formula: C29H39NO7 MolecularWeight: 513.62246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCC1=CC=CC=C1OCC2=CC=CC=C2)(C(=O)OCC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCCCC1=CC=CC=C1OCC2=CC=CC=C2)(C(=O)OCC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C29H39NO7/c1-6-34-25(31)29(26(32)35-7-2,30-27(33)37-28(3,4)5)20-14-13-18-23-17-11-12-19-24(23)36-21-22-15-9-8-10-16-22/h8-12,15-17,19H,6-7,13-14,18,20-21H2,1-5H3,(H,30,33)