(4-nitrophenyl)methyl 3-oxidanylidenepiperazine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-oxidanylidenepiperazine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-oxopiperazine-1-carboxylate CAS Name: 3-oxo-1-piperazinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-oxopiperazine-1-carboxylate Traditional Name: 3-ketopiperazine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O5/c16-11-7-14(6-5-13-11)12(17)20-8-9-1-3-10(4-2-9)15(18)19/h1-4H,5-8H2,(H,13,16)