bis(phenylmethyl) 2-[2-cyclohexyl-1-(phenylmethoxycarbonylamino)ethyl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[2-cyclohexyl-1-(phenylmethoxycarbonylamino)ethyl]propanedioate Openeye Name: dibenzyl 2-[1-(benzyloxycarbonylamino)-2-cyclohexyl-ethyl]propanedioate CAS Name: 2-[2-cyclohexyl-1-(phenylmethoxycarbonylamino)ethyl]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[2-cyclohexyl-1-(phenylmethoxycarbonylamino)ethyl]propanedioate Traditional Name: 2-[1-(benzyloxycarbonylamino)-2-cyclohexyl-ethyl]malonic acid dibenzyl ester Formula: C33H37NO6 MolecularWeight: 543.64998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC(C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H37NO6/c35-31(38-22-26-15-7-2-8-16-26)30(32(36)39-23-27-17-9-3-10-18-27)29(21-25-13-5-1-6-14-25)34-33(37)40-24-28-19-11-4-12-20-28/h2-4,7-12,15-20,25,29-30H,1,5-6,13-14,21-24H2,(H,34,37)