N-(3-iodanylphenyl)-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-(3-iodanylphenyl)-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-(3-iodophenyl)-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-(3-iodophenyl)-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-(3-iodophenyl)-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-(3-iodophenyl)-1-keto-2H-isoquinoline-3-carboxamide Formula: C16H11IN2O2 MolecularWeight: 390.17521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NC3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NC3=CC(=CC=C3)I

InChI

InChI=1S/C16H11IN2O2/c17-11-5-3-6-12(9-11)18-16(21)14-8-10-4-1-2-7-13(10)15(20)19-14/h1-9H,(H,18,21)(H,19,20)