2-[1-(furan-2-ylmethyl)piperidin-4-yl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[1-(furan-2-ylmethyl)piperidin-4-yl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[1-(2-furylmethyl)-4-piperidyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[1-(2-furanylmethyl)-4-piperidinyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[1-(furan-2-ylmethyl)piperidin-4-yl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[1-(2-furfuryl)-4-piperidyl]-5-nitro-isoindoline-1,3-quinone Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1CN(CCC1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C18H17N3O5/c22-17-15-4-3-13(21(24)25)10-16(15)18(23)20(17)12-5-7-19(8-6-12)11-14-2-1-9-26-14/h1-4,9-10,12H,5-8,11H2