bis(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-hexanedioate

Systemtic Name: bis(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-hexanedioate Openeye Name: dibenzyl (2S)-2-(tert-butoxycarbonylamino)-4-oxo-hexanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxohexanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxohexanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-4-keto-adipic acid dibenzyl ester Formula: C25H29NO7 MolecularWeight: 455.50026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO7/c1-25(2,3)33-24(30)26-21(23(29)32-17-19-12-8-5-9-13-19)14-20(27)15-22(28)31-16-18-10-6-4-7-11-18/h4-13,21H,14-17H2,1-3H3,(H,26,30)/t21-/m0/s1