(5-nitro-3-oxidanylidene-1H-isoindol-2-yl)methyl piperidine-1-carboxylate

Systemtic Name: (5-nitro-3-oxidanylidene-1H-isoindol-2-yl)methyl piperidine-1-carboxylate Openeye Name: (6-nitro-1-oxo-isoindolin-2-yl)methyl piperidine-1-carboxylate CAS Name: 1-piperidinecarboxylic acid (5-nitro-3-oxo-1H-isoindol-2-yl)methyl ester IUPAC Name: (5-nitro-3-oxo-1H-isoindol-2-yl)methyl piperidine-1-carboxylate Traditional Name: piperidine-1-carboxylic acid (1-keto-6-nitro-isoindolin-2-yl)methyl ester Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)OCN2CC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)OCN2CC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O5/c19-14-13-8-12(18(21)22)5-4-11(13)9-17(14)10-23-15(20)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7,9-10H2