(3R)-1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]pyrrolidine-2,5-dione Openeye Name: (3R)-1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-ethoxyphenyl)-3-[2-(4-methyl-1-piperidin-1-iumyl)ethylamino]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-ethoxyphenyl)-3-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]pyrrolidine-2,5-dione Traditional Name: (3R)-3-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]-1-p-phenetyl-pyrrolidine-2,5-quinone Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC[NH+]3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)NCC[NH+]3CCC(CC3)C

InChI

InChI=1S/C20H29N3O3/c1-3-26-17-6-4-16(5-7-17)23-19(24)14-18(20(23)25)21-10-13-22-11-8-15(2)9-12-22/h4-7,15,18,21H,3,8-14H2,1-2H3/p+1/t18-/m1/s1