O2-tert-butyl O1-(phenylmethyl) 1-[2-(methylamino)ethanoyl]pyrrolidin-1-ium-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-(phenylmethyl) 1-[2-(methylamino)ethanoyl]pyrrolidin-1-ium-1,2-dicarboxylate Openeye Name: O1-benzyl O2-tert-butyl 1-[2-(methylamino)acetyl]pyrrolidin-1-ium-1,2-dicarboxylate CAS Name: 1-[2-(methylamino)-1-oxoethyl]pyrrolidin-1-ium-1,2-dicarboxylic acid O2-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-tert-butyl 1-[2-(methylamino)acetyl]pyrrolidin-1-ium-1,2-dicarboxylate Traditional Name: 1-sarcosylpyrrolidin-1-ium-1,2-dicarboxylic acid O1-benzyl ester O2-tert-butyl ester Formula: C20H29N2O5+ MolecularWeight: 377.45466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC[N+]1(C(=O)CNC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1CCC[N+]1(C(=O)CNC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H29N2O5/c1-20(2,3)27-18(24)16-11-8-12-22(16,17(23)13-21-4)19(25)26-14-15-9-6-5-7-10-15/h5-7,9-10,16,21H,8,11-14H2,1-4H3/q+1