O1-tert-butyl O7-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-heptanedioate

Systemtic Name: O1-tert-butyl O7-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-heptanedioate Openeye Name: O7-benzyl O1-tert-butyl (2S)-2-(tert-butoxycarbonylamino)-5-oxo-heptanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxoheptanedioic acid O1-tert-butyl ester O7-(phenylmethyl) ester IUPAC Name: 7-O-benzyl 1-O-tert-butyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxoheptanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-keto-pimelic acid O7-benzyl ester O1-tert-butyl ester Formula: C23H33NO7 MolecularWeight: 435.51062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33NO7/c1-22(2,3)30-20(27)18(24-21(28)31-23(4,5)6)13-12-17(25)14-19(26)29-15-16-10-8-7-9-11-16/h7-11,18H,12-15H2,1-6H3,(H,24,28)/t18-/m0/s1