bis(phenylmethyl) 2-[(S)-cyclohexyl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(S)-cyclohexyl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]propanedioate Openeye Name: dibenzyl 2-[(S)-(tert-butoxycarbonylamino)-cyclohexyl-methyl]propanedioate CAS Name: 2-[(S)-cyclohexyl-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(S)-cyclohexyl-[(2-methylpropan-2-yl)oxycarbonylamino]methyl]propanedioate Traditional Name: 2-[(S)-(tert-butoxycarbonylamino)-cyclohexyl-methyl]malonic acid dibenzyl ester Formula: C29H37NO6 MolecularWeight: 495.60718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1CCCCC1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C1CCCCC1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H37NO6/c1-29(2,3)36-28(33)30-25(23-17-11-6-12-18-23)24(26(31)34-19-21-13-7-4-8-14-21)27(32)35-20-22-15-9-5-10-16-22/h4-5,7-10,13-16,23-25H,6,11-12,17-20H2,1-3H3,(H,30,33)/t25-/m0/s1