(2S)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-N-indan-5-yl-propanamide CAS Name: (2S)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-hydroxy-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(2,3-dihydro-1H-inden-5-yl)-2-(4-hydroxypiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-N-indan-5-yl-propionamide Formula: C17H25N2O2+ MolecularWeight: 289.3926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(CCC2)C=C1)[NH+]3CCC(CC3)O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=C(CCC2)C=C1)[NH+]3CCC(CC3)O

InChI

InChI=1S/C17H24N2O2/c1-12(19-9-7-16(20)8-10-19)17(21)18-15-6-5-13-3-2-4-14(13)11-15/h5-6,11-12,16,20H,2-4,7-10H2,1H3,(H,18,21)/p+1/t12-/m0/s1