(3S)-1-ethyl-3-[4-(phenylmethyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-ethyl-3-[4-(phenylmethyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3S)-3-(4-benzylpiperidin-1-ium-1-yl)-1-ethyl-pyrrolidine-2,5-dione CAS Name: (3S)-1-ethyl-3-[4-(phenylmethyl)-1-piperidin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(4-benzylpiperidin-1-ium-1-yl)-1-ethylpyrrolidine-2,5-dione Traditional Name: (3S)-3-(4-benzylpiperidin-1-ium-1-yl)-1-ethyl-pyrrolidine-2,5-quinone Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(C1=O)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C[C@@H](C1=O)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H24N2O2/c1-2-20-17(21)13-16(18(20)22)19-10-8-15(9-11-19)12-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13H2,1H3/p+1/t16-/m0/s1