(1-phenylpyrazol-4-yl)methyl 4-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 4-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate Openeye Name: (1-phenylpyrazol-4-yl)methyl 4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate CAS Name: 4-[(2,5-dioxo-1-imidazolidinyl)methyl]benzoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2,5-diketoimidazolidin-1-yl)methyl]benzoic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)N1)CC2=CC=C(C=C2)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C(=O)N1)CC2=CC=C(C=C2)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O4/c26-19-11-22-21(28)24(19)12-15-6-8-17(9-7-15)20(27)29-14-16-10-23-25(13-16)18-4-2-1-3-5-18/h1-10,13H,11-12,14H2,(H,22,28)