1-(2,3-dihydroindol-1-yl)-3-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-3-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]propan-1-one Openeye Name: 3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-3-[(3S)-3-hydroxy-1-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]propan-1-one Traditional Name: 3-[(3S)-3-hydroxypiperidin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCC(=O)N2CCC3=CC=CC=C32)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCC(=O)N2CCC3=CC=CC=C32)O

InChI

InChI=1S/C16H22N2O2/c19-14-5-3-9-17(12-14)10-8-16(20)18-11-7-13-4-1-2-6-15(13)18/h1-2,4,6,14,19H,3,5,7-12H2/p+1/t14-/m0/s1