2-[5-nitro-1,3-bis(oxidanylidene)-6-piperidin-1-yl-isoindol-2-yl]ethanoic acid

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)-6-piperidin-1-yl-isoindol-2-yl]ethanoic acid Openeye Name: 2-[5-nitro-1,3-dioxo-6-(1-piperidyl)isoindolin-2-yl]acetic acid CAS Name: 2-[5-nitro-1,3-dioxo-6-(1-piperidinyl)-2-isoindolyl]acetic acid IUPAC Name: 2-(5-nitro-1,3-dioxo-6-piperidin-1-ylisoindol-2-yl)acetic acid Traditional Name: 2-(1,3-diketo-5-nitro-6-piperidino-isoindolin-2-yl)acetic acid Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C3C(=C2)C(=O)N(C3=O)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C3C(=C2)C(=O)N(C3=O)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O6/c19-13(20)8-17-14(21)9-6-11(16-4-2-1-3-5-16)12(18(23)24)7-10(9)15(17)22/h6-7H,1-5,8H2,(H,19,20)