1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-one

Systemtic Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-one Openeye Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-one CAS Name: 1-[(4-nitrophenyl)methyl]-4-piperidin-1-iumone IUPAC Name: 1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-one Traditional Name: 1-(4-nitrobenzyl)piperidin-1-ium-4-one Formula: C12H15N2O3+ MolecularWeight: 235.2591

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O3/c15-12-5-7-13(8-6-12)9-10-1-3-11(4-2-10)14(16)17/h1-4H,5-9H2/p+1