(phenylmethyl) 2-[(2S,5S)-5-methyl-3,6-bis(oxidanylidene)piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(2S,5S)-5-methyl-3,6-bis(oxidanylidene)piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[(2S,5S)-5-methyl-3,6-dioxo-piperazin-2-yl]acetate CAS Name: 2-[(2S,5S)-5-methyl-3,6-dioxo-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2S,5S)-5-methyl-3,6-dioxopiperazin-2-yl]acetate Traditional Name: 2-[(2S,5S)-3,6-diketo-5-methyl-piperazin-2-yl]acetic acid benzyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(=O)N1)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1C(=O)N[C@H](C(=O)N1)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H16N2O4/c1-9-13(18)16-11(14(19)15-9)7-12(17)20-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,15,19)(H,16,18)/t9-,11-/m0/s1