bis(phenylmethyl) 2-[(3S,4S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-hexyl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(3S,4S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-hexyl]propanedioate Openeye Name: dibenzyl 2-[(3S,4S)-3-(tert-butoxycarbonylamino)-4-methyl-2-oxo-hexyl]propanedioate CAS Name: 2-[(3S,4S)-4-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxohexyl]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(3S,4S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxohexyl]propanedioate Traditional Name: 2-[(3S,4S)-3-(tert-butoxycarbonylamino)-2-keto-4-methyl-hexyl]malonic acid dibenzyl ester Formula: C29H37NO7 MolecularWeight: 511.60658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)CC(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)CC(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C29H37NO7/c1-6-20(2)25(30-28(34)37-29(3,4)5)24(31)17-23(26(32)35-18-21-13-9-7-10-14-21)27(33)36-19-22-15-11-8-12-16-22/h7-16,20,23,25H,6,17-19H2,1-5H3,(H,30,34)/t20-,25-/m0/s1