(2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide

Systemtic Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide Openeye Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide CAS Name: (2S)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-(2-nitrophenyl)propanamide IUPAC Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-nitrophenyl)propanamide Traditional Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-nitrophenyl)propionamide Formula: C15H22N3O3+ MolecularWeight: 292.35348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O3/c1-11-6-5-9-17(10-11)12(2)15(19)16-13-7-3-4-8-14(13)18(20)21/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,16,19)/p+1/t11-,12-/m0/s1