3-[3-(4-ethanoylpiperazin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid

Systemtic Name: 3-[3-(4-ethanoylpiperazin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid Openeye Name: 3-[3-(4-acetylpiperazin-1-yl)-2,5-dioxo-pyrrolidin-1-yl]benzoic acid CAS Name: 3-[3-(4-acetyl-1-piperazinyl)-2,5-dioxo-1-pyrrolidinyl]benzoic acid IUPAC Name: 3-[3-(4-acetylpiperazin-1-yl)-2,5-dioxopyrrolidin-1-yl]benzoic acid Traditional Name: 3-[3-(4-acetylpiperazino)-2,5-diketo-pyrrolidino]benzoic acid Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H19N3O5/c1-11(21)18-5-7-19(8-6-18)14-10-15(22)20(16(14)23)13-4-2-3-12(9-13)17(24)25/h2-4,9,14H,5-8,10H2,1H3,(H,24,25)