2-(3-methylbutyl)-1,3-bis(oxidanylidene)-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxamide

Systemtic Name: 2-(3-methylbutyl)-1,3-bis(oxidanylidene)-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxamide Openeye Name: 2-isopentyl-1,3-dioxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)isoindoline-5-carboxamide CAS Name: 2-(3-methylbutyl)-1,3-dioxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-5-isoindolecarboxamide IUPAC Name: 2-(3-methylbutyl)-1,3-dioxo-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)isoindole-5-carboxamide Traditional Name: 2-isoamyl-1,3-diketo-N-(5-keto-1-phenyl-2-pyrazolin-3-yl)isoindoline-5-carboxamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O4/c1-14(2)10-11-26-22(30)17-9-8-15(12-18(17)23(26)31)21(29)24-19-13-20(28)27(25-19)16-6-4-3-5-7-16/h3-9,12,14H,10-11,13H2,1-2H3,(H,24,25,29)