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

Systemtic Name: 5-[2,5-bis(oxidanylidene)-3-(4-phenylpiperazin-1-yl)pyrrolidin-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 5-[2,5-dioxo-3-(4-phenylpiperazin-1-yl)pyrrolidin-1-yl]-2-hydroxy-benzoic acid CAS Name: 5-[2,5-dioxo-3-(4-phenyl-1-piperazinyl)-1-pyrrolidinyl]-2-hydroxybenzoic acid IUPAC Name: 5-[2,5-dioxo-3-(4-phenylpiperazin-1-yl)pyrrolidin-1-yl]-2-hydroxybenzoic acid Traditional Name: 5-[2,5-diketo-3-(4-phenylpiperazino)pyrrolidino]-2-hydroxy-benzoic acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC(=O)N(C2=O)C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2CC(=O)N(C2=O)C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O5/c25-18-7-6-15(12-16(18)21(28)29)24-19(26)13-17(20(24)27)23-10-8-22(9-11-23)14-4-2-1-3-5-14/h1-7,12,17,25H,8-11,13H2,(H,28,29)