(3S)-1-ethyl-3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-ethyl-3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3S)-1-ethyl-3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione CAS Name: (3S)-1-ethyl-3-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3S)-1-ethyl-3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-dione Traditional Name: (3S)-1-ethyl-3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pyrrolidine-2,5-quinone Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(C1=O)[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=O)C[C@@H](C1=O)[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H23N3O3/c1-3-20-16(21)12-15(17(20)22)19-10-8-18(9-11-19)13-4-6-14(23-2)7-5-13/h4-7,15H,3,8-12H2,1-2H3/p+1/t15-/m0/s1