(3S)-1-(4-methoxyphenyl)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]pyrrolidine-2,5-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H22N2O3/c1-12-4-3-9-18(11-12)15-10-16(20)19(17(15)21)13-5-7-14(22-2)8-6-13/h5-8,12,15H,3-4,9-11H2,1-2H3/p+1/t12-,15-/m0/s1