(3S)-3-(4-ethylpiperazin-1-ium-1-yl)-1-phenyl-pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(4-ethylpiperazin-1-ium-1-yl)-1-phenyl-pyrrolidine-2,5-dione Openeye Name: (3S)-3-(4-ethylpiperazin-1-ium-1-yl)-1-phenyl-pyrrolidine-2,5-dione CAS Name: (3S)-3-(4-ethyl-1-piperazin-1-iumyl)-1-phenylpyrrolidine-2,5-dione IUPAC Name: (3S)-3-(4-ethylpiperazin-1-ium-1-yl)-1-phenylpyrrolidine-2,5-dione Traditional Name: (3S)-3-(4-ethylpiperazin-1-ium-1-yl)-1-phenyl-pyrrolidine-2,5-quinone Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCN1CC[NH+](CC1)[C@H]2CC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H21N3O2/c1-2-17-8-10-18(11-9-17)14-12-15(20)19(16(14)21)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3/p+1/t14-/m0/s1