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

Systemtic Name: (3R)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-1-(phenylmethyl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-benzyl-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]-1-(phenylmethyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-1-benzyl-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-dione Traditional Name: (3R)-1-benzyl-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-quinone Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC=C(C=C2)O)C3CC(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C2=CC=C(C=C2)O)[C@@H]3CC(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3/c25-19-8-6-17(7-9-19)18-10-12-23(13-11-18)20-14-21(26)24(22(20)27)15-16-4-2-1-3-5-16/h1-9,18,20,25H,10-15H2/p+1/t20-/m1/s1