2-[(2-azanylidenepiperidin-1-yl)methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(2-azanylidenepiperidin-1-yl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(2-imino-1-piperidyl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(2-imino-1-piperidinyl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(2-iminopiperidin-1-yl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[(2-iminopiperidino)methyl]-4-nitro-isoindoline-1,3-quinone Formula: C14H14N4O4 MolecularWeight: 302.28536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=N)C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(=N)C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4/c15-11-6-1-2-7-16(11)8-17-13(19)9-4-3-5-10(18(21)22)12(9)14(17)20/h3-5,15H,1-2,6-8H2