(2S)-N-(2-nitrophenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(2-nitrophenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-N-(2-nitrophenyl)propanamide CAS Name: (2S)-2-(4-hydroxy-1-piperidin-1-iumyl)-N-(2-nitrophenyl)propanamide IUPAC Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-N-(2-nitrophenyl)propanamide Traditional Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-N-(2-nitrophenyl)propionamide Formula: C14H20N3O4+ MolecularWeight: 294.3263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCC(CC2)O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCC(CC2)O

InChI

InChI=1S/C14H19N3O4/c1-10(16-8-6-11(18)7-9-16)14(19)15-12-4-2-3-5-13(12)17(20)21/h2-5,10-11,18H,6-9H2,1H3,(H,15,19)/p+1/t10-/m0/s1