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

Systemtic Name: (2S)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(3-oxidanylpyridin-1-ium-1-yl)propan-1-one Openeye Name: (2S)-2-(3-hydroxypyridin-1-ium-1-yl)-1-[(2S)-2-methylindolin-1-yl]propan-1-one CAS Name: (2S)-2-(3-hydroxy-1-pyridin-1-iumyl)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-propanone IUPAC Name: (2S)-2-(3-hydroxypyridin-1-ium-1-yl)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]propan-1-one Traditional Name: (2S)-2-(3-hydroxypyridin-1-ium-1-yl)-1-[(2S)-2-methylindolin-1-yl]propan-1-one Formula: C17H19N2O2+ MolecularWeight: 283.34496

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)[N+]3=CC=CC(=C3)O

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)[C@H](C)[N+]3=CC=CC(=C3)O

InChI

InChI=1S/C17H18N2O2/c1-12-10-14-6-3-4-8-16(14)19(12)17(21)13(2)18-9-5-7-15(20)11-18/h3-9,11-13H,10H2,1-2H3/p+1/t12-,13-/m0/s1