(3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-dione Openeye Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-[(2S)-2-ethyl-1-piperidin-1-iumyl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-[(2S)-2-ethylpiperidin-1-ium-1-yl]-1-(4-hydroxyphenyl)pyrrolidine-2,5-quinone Formula: C17H23N2O3+ MolecularWeight: 303.37612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3/c1-2-12-5-3-4-10-18(12)15-11-16(21)19(17(15)22)13-6-8-14(20)9-7-13/h6-9,12,15,20H,2-5,10-11H2,1H3/p+1/t12-,15+/m0/s1