2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-nitrophenyl)acetamide Formula: C15H22N3O3+ MolecularWeight: 292.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H21N3O3/c1-11-7-12(2)9-17(8-11)10-15(19)16-13-3-5-14(6-4-13)18(20)21/h3-6,11-12H,7-10H2,1-2H3,(H,16,19)/p+1/t11-,12-/m1/s1