4-[(2S)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(2S)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(2S)-2-(4-hydroxypiperidin-1-ium-1-yl)propanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[(2S)-2-(4-hydroxy-1-piperidin-1-iumyl)-1-oxopropyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(2S)-2-(4-hydroxypiperidin-1-ium-1-yl)propanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(2S)-2-(4-hydroxypiperidin-1-ium-1-yl)propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+]3CCC(CC3)O

Isomeric SMILES

C[C@@H](C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+]3CCC(CC3)O

InChI

InChI=1S/C16H21N3O3/c1-11(18-8-6-12(20)7-9-18)16(22)19-10-15(21)17-13-4-2-3-5-14(13)19/h2-5,11-12,20H,6-10H2,1H3,(H,17,21)/p+1/t11-/m0/s1