(3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-phenyl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-phenyl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-phenyl-pyrrolidine-2,5-dione CAS Name: (3R)-3-[(2S)-2-ethyl-1-piperidin-1-iumyl]-1-phenylpyrrolidine-2,5-dione IUPAC Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-phenylpyrrolidine-2,5-dione Traditional Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-phenyl-pyrrolidine-2,5-quinone Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C2CC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@@H]2CC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C17H22N2O2/c1-2-13-8-6-7-11-18(13)15-12-16(20)19(17(15)21)14-9-4-3-5-10-14/h3-5,9-10,13,15H,2,6-8,11-12H2,1H3/p+1/t13-,15+/m0/s1