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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CCO)C2CC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CCO)[C@@H]2CC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C17H22N2O3/c20-11-9-13-6-4-5-10-18(13)15-12-16(21)19(17(15)22)14-7-2-1-3-8-14/h1-3,7-8,13,15,20H,4-6,9-12H2/p+1/t13-,15+/m0/s1