(3S)-3-ethyl-3-[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]piperidine-2,6-dione

Systemtic Name: (3S)-3-ethyl-3-[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]piperidine-2,6-dione Openeye Name: (3S)-3-ethyl-3-[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]piperidine-2,6-dione CAS Name: (3S)-3-ethyl-3-[4-(2,4,6-trimethyl-1-pyridin-1-iumyl)phenyl]piperidine-2,6-dione IUPAC Name: (3S)-3-ethyl-3-[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]piperidine-2,6-dione Traditional Name: (3S)-3-ethyl-3-[4-(2,4,6-trimethylpyridin-1-ium-1-yl)phenyl]piperidine-2,6-quinone Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)[N+]3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC[C@]1(CCC(=O)NC1=O)C2=CC=C(C=C2)[N+]3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C21H24N2O2/c1-5-21(11-10-19(24)22-20(21)25)17-6-8-18(9-7-17)23-15(3)12-14(2)13-16(23)4/h6-9,12-13H,5,10-11H2,1-4H3/p+1/t21-/m0/s1