1-[4-[3-(hydroxymethyl)piperidin-1-yl]-3-nitro-phenyl]piperidine-2,6-dione

Systemtic Name: 1-[4-[3-(hydroxymethyl)piperidin-1-yl]-3-nitro-phenyl]piperidine-2,6-dione Openeye Name: 1-[4-[3-(hydroxymethyl)-1-piperidyl]-3-nitro-phenyl]piperidine-2,6-dione CAS Name: 1-[4-[3-(hydroxymethyl)-1-piperidinyl]-3-nitrophenyl]piperidine-2,6-dione IUPAC Name: 1-[4-[3-(hydroxymethyl)piperidin-1-yl]-3-nitrophenyl]piperidine-2,6-dione Traditional Name: 1-[4-(3-methylolpiperidino)-3-nitro-phenyl]piperidine-2,6-quinone Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-])CO

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-])CO

InChI

InChI=1S/C17H21N3O5/c21-11-12-3-2-8-18(10-12)14-7-6-13(9-15(14)20(24)25)19-16(22)4-1-5-17(19)23/h6-7,9,12,21H,1-5,8,10-11H2