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

Systemtic Name: (3R)-1-phenethyl-3-[4-(phenylmethyl)piperidin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3R)-3-(4-benzylpiperidin-1-ium-1-yl)-1-phenethyl-pyrrolidine-2,5-dione CAS Name: (3R)-1-phenethyl-3-[4-(phenylmethyl)-1-piperidin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(4-benzylpiperidin-1-ium-1-yl)-1-phenethylpyrrolidine-2,5-dione Traditional Name: (3R)-3-(4-benzylpiperidin-1-ium-1-yl)-1-phenethyl-pyrrolidine-2,5-quinone Formula: C24H29N2O2+ MolecularWeight: 377.49926

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)C3CC(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)[C@@H]3CC(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O2/c27-23-18-22(24(28)26(23)16-13-19-7-3-1-4-8-19)25-14-11-21(12-15-25)17-20-9-5-2-6-10-20/h1-10,21-22H,11-18H2/p+1/t22-/m1/s1