O5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl] O1-tert-butyl 2-(hexadecanoylamino)pentanedioate

Systemtic Name: O5-[2,5-bis(oxidanylidene)pyrrolidin-1-yl] O1-tert-butyl 2-(hexadecanoylamino)pentanedioate Openeye Name: O1-tert-butyl O5-(2,5-dioxopyrrolidin-1-yl) 2-(hexadecanoylamino)pentanedioate CAS Name: 2-(1-oxohexadecylamino)pentanedioic acid O1-tert-butyl ester O5-(2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: 1-O-tert-butyl 5-O-(2,5-dioxopyrrolidin-1-yl) 2-(hexadecanoylamino)pentanedioate Traditional Name: 2-palmitamidoglutaric acid O1-tert-butyl ester O5-succinimido ester Formula: C29H50N2O7 MolecularWeight: 548.67921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CCC(=O)ON1C(=O)CCC1=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[14CH]([14CH2][14CH2][14C](=O)ON1C(=O)CCC1=O)[14C](=O)OC(C)(C)C

InChI

InChI=1S/C29H50N2O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(32)30-23(28(36)37-29(2,3)4)19-22-27(35)38-31-25(33)20-21-26(31)34/h23H,5-22H2,1-4H3,(H,30,32)/i19+2,22+2,23+2,27+2,28+2