(3R)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(3-nitrophenyl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(3-nitrophenyl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-(3-nitrobenzyl)piperidin-1-ium-3-carboxamide Formula: C13H18N3O3+ MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C13H17N3O3/c14-13(17)11-4-2-6-15(9-11)8-10-3-1-5-12(7-10)16(18)19/h1,3,5,7,11H,2,4,6,8-9H2,(H2,14,17)/p+1/t11-/m1/s1