(3S)-1-(3-hydroxyphenyl)-3-(4-methylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-(3-hydroxyphenyl)-3-(4-methylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3S)-1-(3-hydroxyphenyl)-3-(4-methylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione CAS Name: (3S)-1-(3-hydroxyphenyl)-3-(4-methyl-1-piperidin-1-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-1-(3-hydroxyphenyl)-3-(4-methylpiperidin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3S)-1-(3-hydroxyphenyl)-3-(4-methylpiperidin-1-ium-1-yl)pyrrolidine-2,5-quinone Formula: C16H21N2O3+ MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC(=CC=C3)O

Isomeric SMILES

CC1CC[NH+](CC1)[C@H]2CC(=O)N(C2=O)C3=CC(=CC=C3)O

InChI

InChI=1S/C16H20N2O3/c1-11-5-7-17(8-6-11)14-10-15(20)18(16(14)21)12-3-2-4-13(19)9-12/h2-4,9,11,14,19H,5-8,10H2,1H3/p+1/t14-/m0/s1