(3R)-1-(4-ethoxyphenyl)-3-(2-piperidin-1-ium-1-ylethylamino)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(4-ethoxyphenyl)-3-(2-piperidin-1-ium-1-ylethylamino)pyrrolidine-2,5-dione Openeye Name: (3R)-1-(4-ethoxyphenyl)-3-(2-piperidin-1-ium-1-ylethylamino)pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-ethoxyphenyl)-3-[2-(1-piperidin-1-iumyl)ethylamino]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-ethoxyphenyl)-3-(2-piperidin-1-ium-1-ylethylamino)pyrrolidine-2,5-dione Traditional Name: (3R)-3-(2-piperidin-1-ium-1-ylethylamino)-1-p-phenetyl-pyrrolidine-2,5-quinone Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)NCC[NH+]3CCCCC3

InChI

InChI=1S/C19H27N3O3/c1-2-25-16-8-6-15(7-9-16)22-18(23)14-17(19(22)24)20-10-13-21-11-4-3-5-12-21/h6-9,17,20H,2-5,10-14H2,1H3/p+1/t17-/m1/s1