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

Systemtic Name: 2-butyl-1,3-bis(oxidanylidene)-N-(1H-pyrazol-4-yl)isoindole-5-carboxamide Openeye Name: 2-butyl-1,3-dioxo-N-(1H-pyrazol-4-yl)isoindoline-5-carboxamide CAS Name: 2-butyl-1,3-dioxo-N-(1H-pyrazol-4-yl)-5-isoindolecarboxamide IUPAC Name: 2-butyl-1,3-dioxo-N-(1H-pyrazol-4-yl)isoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-(1H-pyrazol-4-yl)isoindoline-5-carboxamide Formula: C16H16N4O3 MolecularWeight: 312.32324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CNN=C3

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CNN=C3

InChI

InChI=1S/C16H16N4O3/c1-2-3-6-20-15(22)12-5-4-10(7-13(12)16(20)23)14(21)19-11-8-17-18-9-11/h4-5,7-9H,2-3,6H2,1H3,(H,17,18)(H,19,21)