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

Systemtic Name: 5-nitro-2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]isoindole-1,3-dione Openeye Name: 5-nitro-2-[1-(3-pyridylmethyl)-4-piperidyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-[1-(3-pyridinylmethyl)-4-piperidinyl]isoindole-1,3-dione IUPAC Name: 5-nitro-2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]isoindole-1,3-dione Traditional Name: 5-nitro-2-[1-(3-pyridylmethyl)-4-piperidyl]isoindoline-1,3-quinone Formula: C19H18N4O4 MolecularWeight: 366.37062

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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=CN=CC=C4

Isomeric SMILES

C1CN(CCC1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CC4=CN=CC=C4

InChI

InChI=1S/C19H18N4O4/c24-18-16-4-3-15(23(26)27)10-17(16)19(25)22(18)14-5-8-21(9-6-14)12-13-2-1-7-20-11-13/h1-4,7,10-11,14H,5-6,8-9,12H2