[3-(hydroxymethyl)piperidin-1-yl]-(2-iodanyl-5-nitro-phenyl)methanone

Systemtic Name: [3-(hydroxymethyl)piperidin-1-yl]-(2-iodanyl-5-nitro-phenyl)methanone Openeye Name: [3-(hydroxymethyl)-1-piperidyl]-(2-iodo-5-nitro-phenyl)methanone CAS Name: [3-(hydroxymethyl)-1-piperidinyl]-(2-iodo-5-nitrophenyl)methanone IUPAC Name: [3-(hydroxymethyl)piperidin-1-yl]-(2-iodo-5-nitrophenyl)methanone Traditional Name: (2-iodo-5-nitro-phenyl)-(3-methylolpiperidino)methanone Formula: C13H15IN2O4 MolecularWeight: 390.17367

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I)CO

InChI

InChI=1S/C13H15IN2O4/c14-12-4-3-10(16(19)20)6-11(12)13(18)15-5-1-2-9(7-15)8-17/h3-4,6,9,17H,1-2,5,7-8H2