N-(3-chloranyl-4-fluoranyl-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1,3-diketo-2-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C21H13ClFN3O3 MolecularWeight: 409.797623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)N(C2=O)CC4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1C(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)N(C2=O)CC4=CC=NC=C4

InChI

InChI=1S/C21H13ClFN3O3/c22-17-10-14(2-4-18(17)23)25-19(27)13-1-3-15-16(9-13)21(29)26(20(15)28)11-12-5-7-24-8-6-12/h1-10H,11H2,(H,25,27)