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

Systemtic Name: 2-[[4-(4-hydroxyphenyl)piperidin-1-yl]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[4-(4-hydroxyphenyl)-1-piperidyl]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[4-(4-hydroxyphenyl)-1-piperidinyl]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[4-(4-hydroxyphenyl)piperidin-1-yl]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[4-(4-hydroxyphenyl)piperidino]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5/c24-15-6-4-13(5-7-15)14-8-10-21(11-9-14)12-22-19(25)16-2-1-3-17(23(27)28)18(16)20(22)26/h1-7,14,24H,8-12H2