1-[(3-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidine

Systemtic Name: 1-[(3-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidine Openeye Name: 1-[(3-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidine CAS Name: 1-[(3-nitrophenyl)methyl]-4-(1-pyrrolidin-1-iumyl)piperidine IUPAC Name: 1-[(3-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-ylpiperidine Traditional Name: 1-(3-nitrobenzyl)-4-pyrrolidin-1-ium-1-yl-piperidine Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)C2CCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O2/c20-19(21)16-5-3-4-14(12-16)13-17-10-6-15(7-11-17)18-8-1-2-9-18/h3-5,12,15H,1-2,6-11,13H2/p+1