(3R)-3-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: (3R)-3-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C26H26N3O3+ MolecularWeight: 428.50294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)C3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)[C@@H]3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H25N3O3/c1-18(30)19-9-11-21(12-10-19)27-13-15-28(16-14-27)24-17-25(31)29(26(24)32)23-8-4-6-20-5-2-3-7-22(20)23/h2-12,24H,13-17H2,1H3/p+1/t24-/m1/s1