N-(3-iodanylphenyl)-1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(3-iodanylphenyl)-1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(3-iodophenyl)-1,3-dioxo-2-(3-pyridylmethyl)isoindoline-5-carboxamide CAS Name: N-(3-iodophenyl)-1,3-dioxo-2-(3-pyridinylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(3-iodophenyl)-1,3-dioxo-2-(pyridin-3-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(3-iodophenyl)-1,3-diketo-2-(3-pyridylmethyl)isoindoline-5-carboxamide Formula: C21H14IN3O3 MolecularWeight: 483.25863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)I)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CN=CC=C4

InChI

InChI=1S/C21H14IN3O3/c22-15-4-1-5-16(10-15)24-19(26)14-6-7-17-18(9-14)21(28)25(20(17)27)12-13-3-2-8-23-11-13/h1-11H,12H2,(H,24,26)