O1-cyclohexyl O8-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]octanedioate

Systemtic Name: O1-cyclohexyl O8-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]octanedioate Openeye Name: O8-benzyl O1-cyclohexyl (2S)-2-(tert-butoxycarbonylamino)octanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]octanedioic acid O1-cyclohexyl ester O8-(phenylmethyl) ester IUPAC Name: 8-O-benzyl 1-O-cyclohexyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]octanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)suberic acid O8-benzyl ester O1-cyclohexyl ester Formula: C26H39NO6 MolecularWeight: 461.59096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCCC(=O)OCC1=CC=CC=C1)C(=O)OC2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCCCC(=O)OCC1=CC=CC=C1)C(=O)OC2CCCCC2

InChI

InChI=1S/C26H39NO6/c1-26(2,3)33-25(30)27-22(24(29)32-21-15-9-5-10-16-21)17-11-6-12-18-23(28)31-19-20-13-7-4-8-14-20/h4,7-8,13-14,21-22H,5-6,9-12,15-19H2,1-3H3,(H,27,30)/t22-/m0/s1