4-[[2,3-bis(oxidanylidene)-4-phenyl-piperazin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2,3-bis(oxidanylidene)-4-phenyl-piperazin-1-yl]methyl]benzoic acid Openeye Name: 4-[(2,3-dioxo-4-phenyl-piperazin-1-yl)methyl]benzoic acid CAS Name: 4-[(2,3-dioxo-4-phenyl-1-piperazinyl)methyl]benzoic acid IUPAC Name: 4-[(2,3-dioxo-4-phenylpiperazin-1-yl)methyl]benzoic acid Traditional Name: 4-[(2,3-diketo-4-phenyl-piperazino)methyl]benzoic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O4/c21-16-17(22)20(15-4-2-1-3-5-15)11-10-19(16)12-13-6-8-14(9-7-13)18(23)24/h1-9H,10-12H2,(H,23,24)