2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioic acid; 3-(phenylmethyl)pyrrolidine-2,5-dione

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioic acid; 3-(phenylmethyl)pyrrolidine-2,5-dione Openeye Name: 3-benzylpyrrolidine-2,5-dione; 2-(tert-butoxycarbonylamino)butanedioic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid; 3-(phenylmethyl)pyrrolidine-2,5-dione IUPAC Name: 3-benzylpyrrolidine-2,5-dione; 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioic acid Traditional Name: 3-benzylpyrrolidine-2,5-quinone; 2-(tert-butoxycarbonylamino)succinic acid Formula: C20H26N2O8 MolecularWeight: 422.42904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)O.C1C(C(=O)NC1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)O.C1C(C(=O)NC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C11H11NO2.C9H15NO6/c13-10-7-9(11(14)12-10)6-8-4-2-1-3-5-8;1-9(2,3)16-8(15)10-5(7(13)14)4-6(11)12/h1-5,9H,6-7H2,(H,12,13,14);5H,4H2,1-3H3,(H,10,15)(H,11,12)(H,13,14)