(4-bromanyl-3-nitro-phenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone

Systemtic Name: (4-bromanyl-3-nitro-phenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone Openeye Name: (4-bromo-3-nitro-phenyl)-[3-(hydroxymethyl)-1-piperidyl]methanone CAS Name: (4-bromo-3-nitrophenyl)-[3-(hydroxymethyl)-1-piperidinyl]methanone IUPAC Name: (4-bromo-3-nitrophenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: (4-bromo-3-nitro-phenyl)-(3-methylolpiperidino)methanone Formula: C13H15BrN2O4 MolecularWeight: 343.1732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O4/c14-11-4-3-10(6-12(11)16(19)20)13(18)15-5-1-2-9(7-15)8-17/h3-4,6,9,17H,1-2,5,7-8H2