(3R)-1-(3-ethanoylphenyl)-3-piperidin-1-ium-1-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(3-ethanoylphenyl)-3-piperidin-1-ium-1-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-1-(3-acetylphenyl)-3-piperidin-1-ium-1-yl-pyrrolidine-2,5-dione CAS Name: (3R)-1-(3-acetylphenyl)-3-(1-piperidin-1-iumyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(3-acetylphenyl)-3-piperidin-1-ium-1-ylpyrrolidine-2,5-dione Traditional Name: (3R)-1-(3-acetylphenyl)-3-piperidin-1-ium-1-yl-pyrrolidine-2,5-quinone Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C(=O)CC(C2=O)[NH+]3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCCCC3

InChI

InChI=1S/C17H20N2O3/c1-12(20)13-6-5-7-14(10-13)19-16(21)11-15(17(19)22)18-8-3-2-4-9-18/h5-7,10,15H,2-4,8-9,11H2,1H3/p+1/t15-/m1/s1